SCHEMBL7208136

SCHEMBL7208136

O=C(Nc1ccccc1)c1cc2ccccc2[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 1.00
RAB9A P51151 2/20 1.00
LMNA P02545 1/20 1.00
SMN1; SMN2 Q16637 1/20 1.00
EGFR P00533 8/20 0.78
PIK3CA P42336 8/20 0.78
IDO1 P14902 1/20 0.72
TP53 P04637 1/20 0.71
POLB P06746 1/20 0.71
KDM4E B2RXH2 2/20 0.66
ALDH1A1 P00352 1/20 0.66
GAA P10253 1/20 0.66
MAPK1 P28482 1/20 0.66
MAPT P10636 1/20 0.64
DAO P14920 1/20 0.64
HPGD P15428 1/20 0.64
SRD5A2 P31213 1/20 0.64
HSD17B10 Q99714 1/20 0.64
KDM1A O60341 1/20 0.64
RCOR1 Q9UKL0 1/20 0.64

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29475123 1.00 NPC1 (1.00) NPC1RAB9ALMNASMN1; SMN2EGFR
Hydrochloric Acid SCHEMBL16465542 0.98 NPC1 (0.97) NPC1RAB9ALMNASMN1; SMN2EGFR
SCHEMBL8769590 0.90 NPC1 (0.82) NPC1RAB9ALMNASMN1; SMN2EGFR
SCHEMBL16627058 0.88 NPC1 (0.78) NPC1RAB9ALMNASMN1; SMN2EGFR
SCHEMBL6037548 0.88 NPC1 (0.78) NPC1RAB9ALMNASMN1; SMN2EGFR
SCHEMBL19476163 0.88 NPC1 (0.78) NPC1RAB9ALMNASMN1; SMN2EGFR
SCHEMBL17433428 0.88 NPC1 (0.78) NPC1RAB9ALMNASMN1; SMN2EGFR
SCHEMBL27335879 0.88 NPC1 (0.78) NPC1RAB9ALMNASMN1; SMN2EGFR
SCHEMBL7590295 0.88 NPC1 (0.78) NPC1RAB9ALMNASMN1; SMN2EGFR
SCHEMBL5818325 0.86 NPC1 (0.75) NPC1RAB9ALMNASMN1; SMN2EGFR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111171040-A Dihydrofuropyran/pyridoindole derivatives and synthesis method thereof 常州大学 2020-05-19 CN claimed
JP-2003508382-A 2003-03-04 JP claimed
EP-1212296-A1 PHOSPHATE MIMICS AND METHODS OF TREATMENT USING PHOSPHATASE INHIBITORS Sugen, Inc. (US) 2002-06-12 EP claimed
WO-2001016097-A1 PHOSPHATE MIMICS AND METHODS OF TREATMENT USING PHOSPHATASE INHIBITORS SUGEN, INC. (US) 2001-03-08 WO claimed
CN-117447381-A Indole amide derivative and its application in preparing beta 2 Use of adrenoreceptor allosteric antagonist medicaments 常州大学 2024-01-26 CN disclosed
CN-109475521-B Anti-proprotein convertase subtilisin Kexin type 9 (anti-PCSK 9) compounds and methods of use thereof for treating and/or preventing cardiovascular diseases 实发生物医学公司 2022-11-15 CN disclosed
US-10947220-B2 Anti-proprotein convertase subtilisin kexin type 9 (anti-PCSK9) compounds and methods of using the same in the treatment and/or prevention of cardiovascular diseases SHIFA BIOMEDICAL CORPORATION (US) 2021-03-16 US disclosed
US-10899748-B2 Anti-proprotein convertase subtilisin kexin type 9 (anti-PCSK9) compounds and methods of using the same in the treatment and/or prevention of cardiovascular diseases SHIFA BIOMEDICAL CORPORATION (US) 2021-01-26 US disclosed
US-10759765-B2 Heterocyclic carboxylic acid amide ligand and applications thereof in copper catalyzed coupling reaction of aryl halogeno substitute CE PHARM CO., LTD. (CN) 2020-09-01 US disclosed
US-20200262822-A1 Anti-Proprotein Convertase Subtilisin Kexin Type 9 (Anti-PCSK9) Compounds and Methods of Using the Same in the Treatment and/or Prevention of Cardiovascular Diseases SHIFA BIOMEDICAL CORPORATION 2020-08-20 US disclosed
CN-111171040-A Dihydrofuropyran/pyridoindole derivatives and synthesis method thereof 常州大学 2020-05-19 CN disclosed
US-20190270729-A1 Anti-Proprotein Convertase Subtilisin Kexin Type 9 (Anti-PCSK9) Compounds and Methods of Using the Same in the Treatment and/or Prevention of Cardiovascular Diseases NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2019-09-05 US disclosed
US-20190127337-A1 HETEROCYCLIC CARBOXYLIC ACID AMIDE LIGAND AND APPLICATIONS THEREOF IN COPPER CATALYZED COUPLING REACTION OF ARYL HALOGENO SUBSTITUTE CE PHARM CO., LTD. (CN) 2019-05-02 US disclosed
EP-3471714-A1 ANTI-PROPROTEIN CONVERTASE SUBTILISIN KEXIN TYPE 9 (ANTI-PCSK9) COMPOUNDS AND METHODS OF USING THE SAME IN THE TREATMENT AND/OR PREVENTION OF CARDIOVASCULAR DISEASES Shifa Biomedical Corporation (US) 2019-04-24 EP disclosed
EP-3444031-A1 HETEROCYCLIC CARBOXYLIC ACID AMIDE LIGAND AND APPLICATIONS THEREOF IN COPPER CATALYZED COUPLING REACTION OF ARYL HALOGENO SUBSTITUTE Shanghai Institute of Organic Chemistry, Chinese Academy of Sciences (CN) 2019-02-20 EP disclosed
WO-2017222953-A1 ANTI-PROPROTEIN CONVERTASE SUBTILISIN KEXIN TYPE 9 (ANTI-PCSK9) COMPOUNDS AND METHODS OF USING THE SAME IN THE TREATMENT AND/OR PREVENTION OF CARDIOVASCULAR DISEASES SHIFA BIOMEDICAL CORPORATION (US) 2017-12-28 WO disclosed
WO-2017177979-A1 HETEROCYCLIC CARBOXYLIC ACID AMIDE LIGAND AND APPLICATIONS THEREOF IN COPPER CATALYZED COUPLING REACTION OF ARYL HALOGENO SUBSTITUTE 中国科学院上海有机化学研究所 2017-10-19 WO disclosed
US-20110207767-A1 Novel cc-1065 Analogs and Their Conjugates BYONDIS B.V. (NL) 2011-08-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10899748-B2 Anti-proprotein convertase subtilisin kexin type 9 (anti-PCSK9) compounds and methods of using the same in the treatment and/or prevention of cardiovascular diseases PCSK9, PCSK6, PCSK7 NPC1 120/4885RAB9A 1970/4885LMNA 101/4885
US-20200262822-A1 Anti-Proprotein Convertase Subtilisin Kexin Type 9 (Anti-PCSK9) Compounds and Methods of Using the Same in the Treatment and/or Prevention of Cardiovascular Diseases PCSK9, PCSK6, PCSK7 NPC1 120/4885RAB9A 1970/4885LMNA 101/4885
US-20190127337-A1 HETEROCYCLIC CARBOXYLIC ACID AMIDE LIGAND AND APPLICATIONS THEREOF IN COPPER CATALYZED COUPLING REACTION OF ARYL HALOGENO SUBSTITUTE AOC1, AOC2, AOC3 NPC1 3545/4885RAB9A 2403/4885LMNA 4664/4885
US-20110207767-A1 Novel cc-1065 Analogs and Their Conjugates PCNA, CDC5L, TOP1 NPC1 3077/4885RAB9A 3318/4885LMNA 2883/4885
US-10759765-B2 Heterocyclic carboxylic acid amide ligand and applications thereof in copper catalyzed coupling reaction of aryl halogeno substitute AOC1, AOC2, AOC3 NPC1 3545/4885RAB9A 2403/4885LMNA 4664/4885
US-20190270729-A1 Anti-Proprotein Convertase Subtilisin Kexin Type 9 (Anti-PCSK9) Compounds and Methods of Using the Same in the Treatment and/or Prevention of Cardiovascular Diseases PCSK9, PCSK6, PCSK7 NPC1 120/4885RAB9A 1970/4885LMNA 101/4885
US-10947220-B2 Anti-proprotein convertase subtilisin kexin type 9 (anti-PCSK9) compounds and methods of using the same in the treatment and/or prevention of cardiovascular diseases PCSK9, PCSK6, PCSK7 NPC1 120/4885RAB9A 1970/4885LMNA 101/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.