SCHEMBL3420518

SCHEMBL3420518

CCN(CC)CCOc1ccc(C)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EBP Q15125 2/20 0.64
SIGMAR1 Q99720 2/20 0.64
CYP1A2 P05177 1/20 0.62
LTA4H P09960 1/20 0.62
CYP2D6 P10635 1/20 0.62
CYP2C9 P11712 1/20 0.62
CYP2C19 P33261 1/20 0.62
HTT P42858 1/20 0.62
MCHR1 Q99705 1/20 0.57
MAPT P10636 1/20 0.56
CHRNA7 P36544 1/20 0.56
KMT2A Q03164 1/20 0.56
ACHE P22303 1/20 0.55
KCNH2 Q12809 1/20 0.54
HRH3 Q9Y5N1 1/20 0.54

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
Hydrochloric Acid SCHEMBL4624885 0.98 EBP (0.62) EBPSIGMAR1CYP1A2LTA4HCYP2D6
SCHEMBL9706125 0.92 EBP (0.72) EBPSIGMAR1CYP1A2LTA4HCYP2D6
SCHEMBL12865043 0.90 KDM4E (0.60) EBPSIGMAR1CYP1A2LTA4HCYP2D6
SCHEMBL10509623 0.88 EBP (0.55) EBPSIGMAR1CYP1A2LTA4HCYP2D6
SCHEMBL11094544 0.87 MAOB (0.57)
Hydrochloric Acid SCHEMBL10572505 0.86 EBP (0.51) EBPSIGMAR1CYP1A2LTA4HCYP2D6
Hydrochloric Acid SCHEMBL9259688 0.86 MAPT (0.51) EBPSIGMAR1CYP1A2LTA4HCYP2D6
SCHEMBL11684281 0.84 CYP1A2 (0.66) CYP1A2LTA4HCYP2D6CYP2C9CYP2C19
SCHEMBL14570562 0.82 KCNH2 (0.53) EBPSIGMAR1CYP1A2LTA4HCYP2D6
SCHEMBL1985115 0.82 EBP (0.62) EBPSIGMAR1CYP1A2LTA4HCYP2D6

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 61 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112086450-B Semiconductor device with a semiconductor layer having a plurality of semiconductor layers 三星电子株式会社 2024-10-18 CN disclosed
CN-116155151-A Alternating current generator and variable voltage regulating module thereof 北京佩特来电器有限公司 2023-05-23 CN disclosed
US-11387229-B2 Semiconductor device SAMSUNG ELECTRONICS CO., LTD. (KR) 2022-07-12 US disclosed
CN-216699881-U Alternating-current generator and variable voltage adjusting module thereof 北京佩特来电器有限公司 2022-06-07 CN disclosed
WO-2021003314-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS NUVATION BIO INC. (US) 2021-01-07 WO disclosed
WO-2020210377-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF NUVATION BIO INC. (US) 2020-10-15 WO disclosed
WO-2020210383-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF NUVATION BIO INC. (US) 2020-10-15 WO disclosed
WO-2020070332-A1 OXINDOLE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS ICHNOS SCIENCES S.A. (CH) 2020-04-09 WO disclosed
EP-2975024-B1 TETRACYCLIC COMPOUNDS CHUGAI PHARMACEUTICAL CO LTD (JP) 2018-03-28 EP disclosed
US-RE46511-E1 Fused pyrimidine derivatives for inhibition of tyrosine kinase activity HANMI SCIENCE CO., LTD. (KR) 2017-08-15 US disclosed
US-20070191447-A1 Novel heterocyclic compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-08-16 US disclosed
US-7196080-B2 Respiratory system disordeers; chronic obstructive pulminary disease ASTELLAS PHARMA INC. (JP) 2007-03-27 US disclosed
US-7183409-B2 Basic mono- and bisazo compounds CLARIANT FINANCE (BVI) LIMITED (VG) 2007-02-27 US disclosed
US-7183409-B2 Basic mono- and bisazo compounds CLARIANT FINANCE (BVI) LIMITED (VG) 2007-02-27 US disclosed
WO-2005063239-A9 3-(4-PIPERIDINE-1YLMETHYL-PHENYL)-PROPION ACID-PHENYLAMIDE-DERIVATIVES AND RELATED COMPOUNDS USED IN THE FORM OF MCH ANTAGONISTS (MELANINE CONCENTRATING HORMONE) FOR TREATING EATING DISORDERS BOEHRINGER INGELHEIM INT (DE) 2006-03-09 WO disclosed
WO-2005087761-A1 NOVEL CYCLOALKYL-CONTAINING 5-ACYLINDOLINONES, THEIR PREPARATION AND THEIR USE AS PHARMACEUTICAL PRODUCTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-09-22 WO disclosed
EP-0109563-B1 METHOD OF INCREASING BIOMASS IN PLANTS US AGRICULTURE (US) 1990-10-10 EP disclosed
US-4797153-A PLANT GROWTH REGULATORS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1989-01-10 US disclosed
EP-0109563-A2 Method of increasing biomass in plants THE UNITED STATES OF AMERICA as represented by the Secretary United States Department of Commerce (US) 1984-05-30 EP disclosed
WO-1984001489-A1 METHOD OF INCREASING BIOMASS IN PLANTS US AGRICULTURE (US) 1984-04-26 WO 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 (1 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-20070191447-A1 Novel heterocyclic compound OPRD1, GRIN3A, GRM3 EBP 638/4885SIGMAR1 38/4885CYP1A2 256/4885

“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.