SCHEMBL764284

SCHEMBL764284

CCc1ccc2c(c1)ncn2C

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.66
RAB9A P51151 8/20 0.66
GAA P10253 6/20 0.66
KDM4E B2RXH2 4/20 0.66
SMN1; SMN2 Q16637 4/20 0.66
HPGD P15428 3/20 0.66
HSD17B10 Q99714 2/20 0.66
LMNA P02545 2/20 0.66
HTT P42858 2/20 0.66
ALOX15 P16050 1/20 0.66
ALDH1A1 P00352 4/20 0.54
GFER P55789 2/20 0.52
MAPT P10636 4/20 0.52
KMT2A Q03164 6/20 0.50
POLB P06746 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
GRM5 P41594 1/20 0.49
MEN1 O00255 3/20 0.48
TP53 P04637 2/20 0.43
SHMT2 P34897 1/20 0.43

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
SCHEMBL8738054 0.85 NPC1 (0.54) NPC1RAB9AGAAKDM4ESMN1; SMN2
SCHEMBL17924299 0.84 NPC1 (0.55) NPC1RAB9AGAAKDM4ESMN1; SMN2
SCHEMBL10145473 0.84 NPC1 (0.52) NPC1RAB9AGAAKDM4ESMN1; SMN2
SCHEMBL541672 0.84 NPC1 (0.52) NPC1RAB9AGAAKDM4ESMN1; SMN2
SCHEMBL29880555 0.84 NPC1 (0.52) NPC1RAB9AGAAKDM4ESMN1; SMN2
SCHEMBL12953976 0.84 NPC1 (0.52) NPC1RAB9AGAAKDM4ESMN1; SMN2
SCHEMBL4592448 0.83 NPC1 (0.85) NPC1RAB9AGAAKDM4ESMN1; SMN2
SCHEMBL21240926 0.83 NPC1 (0.52) NPC1RAB9AGAAKDM4ESMN1; SMN2
SCHEMBL23478960 0.81 NPC1 (0.50) NPC1RAB9AGAAKDM4ESMN1; SMN2
SCHEMBL6125744 0.81 NPC1 (0.50) NPC1RAB9AGAAKDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12030853-B2 MASP-2 inhibitors and methods of use OMEROS CORPORATION (US) 2024-07-09 US disclosed
WO-2023154124-A1 ACYLATED HETEROCYCLIC QUINAZOLINE DERIVATIVES AS INHIBITORS OF ERBB2 ENLIVEN THERAPEUTICS, INC. (US) 2023-08-17 WO disclosed
US-20230183237-A1 COMPETITIVE AND NONCOMPETITIVE INHIBITORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M5 VANDERBILT UNIVERSITY 2023-06-15 US disclosed
WO-2023092175-A1 NOVEL P2X7 RECEPTOR ANTAGONISTS THE UNIVERSITY OF SYDNEY (AU) 2023-06-01 WO disclosed
WO-2022140769-A1 LACTAM (HETERO)ARYLFUSEDPYRIMIDINE DERIVATIVES AS INHIBITORS OF ERBB2 ENLIVEN THERAPEUTICS, INC. (US) 2022-06-30 WO disclosed
WO-2021114315-A1 USE OF HETEROCYCLIC DERIVATIVES WITH CARDIOMYOCYTE PROLIFERATION ACTIVITY FOR TREATMENT OF HEART DISEASES SHANGHAI EAST HOSPITAL (CN) 2021-06-17 WO disclosed
WO-2021114314-A1 NOVEL HETEROCYCLIC DERIVATIVES WITH CARDIOMYOCYTE PROLIFERATION ACTIVITY FOR TREATMENT OF HEART DISEASES TONGJI UNIVERSITY (CN) 2021-06-17 WO disclosed
US-20210171461-A1 MASP-2 INHIBITORS AND METHODS OF USE OMEROS CORPORATION 2021-06-10 US disclosed
US-10864202-B2 Inhibitors of lysine specific demethylase-1 CELGENE QUANTICEL RESEARCH, INC. (US) 2020-12-15 US disclosed
US-10865216-B2 Tricyclic Gyrase inhibitors MERCK SHARP & DOHME CORP. (US) 2020-12-15 US disclosed
US-20150031668-A1 CHROMAN DERIVATIVES AS TRPM8 INHIBITORS AMGEN INC (US) 2015-01-29 US disclosed
US-20140171406-A1 TRPM8 ANTAGONISTS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2014-06-19 US disclosed
US-20120245181-A1 OPIOID RECEPTOR LIGANDS AND METHODS OF USING AND MAKING SAME TREVENA, INC. (US) 2012-09-27 US disclosed
US-20120238751-A1 TRICYCLIC GYRASE INHIBITORS TRIUS THERAPEUTICS, INC. (US) 2012-09-20 US disclosed
US-8138339-B2 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2012-03-20 US disclosed
US-20120040960-A1 4-AZETIDINYL-1-PHENYL-CYCLOHEXANE ANTAGONISTS OF CCR2 JANSSEN PHARMACEUTICA N.V. (BE) 2012-02-16 US disclosed
US-20110034689-A1 N4-Phenyl-Quinazoline-4-Amine Derivatives and Related Compounds as ErbB Type I Receptor Tyrosine Kinase Inhibitors for the Treatment of Hyperproliferative Diseases ARRAY BIOPHARMA, INC. 2011-02-10 US disclosed
US-20100267689-A1 4-AZETIDINYL-1-PHENYL-CYCLOHEXANE ANTAGONISTS OF CCR2 JANSSEN PHARMACEUTICA N. V. (BE) 2010-10-21 US disclosed
US-20090318407-A1 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2009-12-24 US disclosed
US-20090270435-A1 Spiroketone Acetyl-CoA Carboxylase Inhibitors CORBETT JEFFREY WAYNE 2009-10-29 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 (14 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-20090318407-A1 Inhibitors of protein kinases SYK, BTK, JAK1 NPC1 4024/4885RAB9A 2919/4885GAA 2777/4885
US-20150031668-A1 CHROMAN DERIVATIVES AS TRPM8 INHIBITORS TRPM8, TRPM5, TRPM7 NPC1 702/4885RAB9A 1056/4885GAA 780/4885
US-20120238751-A1 TRICYCLIC GYRASE INHIBITORS TOP1, TOP2A, TOP2B NPC1 1885/4885RAB9A 3316/4885GAA 85/4885
US-20110034689-A1 N4-Phenyl-Quinazoline-4-Amine Derivatives and Related Compounds as ErbB Type I Receptor Tyrosine Kinase Inhibitors for the Treatment of Hyperproliferative Diseases ERBB4, ERBB2, ERBB3 NPC1 2037/4885RAB9A 1344/4885GAA 2375/4885
US-20230183237-A1 COMPETITIVE AND NONCOMPETITIVE INHIBITORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M5 CHRM5, CHRM1, CHRM2 NPC1 2563/4885RAB9A 1907/4885GAA 4089/4885
US-20120040960-A1 4-AZETIDINYL-1-PHENYL-CYCLOHEXANE ANTAGONISTS OF CCR2 CCR2, CCR1, CCR5 NPC1 1303/4885RAB9A 4177/4885GAA 3203/4885
US-10864202-B2 Inhibitors of lysine specific demethylase-1 KDM1B, KDM1A, KDM3A NPC1 4332/4885RAB9A 3036/4885GAA 1295/4885
US-20090270435-A1 Spiroketone Acetyl-CoA Carboxylase Inhibitors ACACA, PC, ACACB NPC1 715/4885RAB9A 1738/4885GAA 1471/4885
US-20140171406-A1 TRPM8 ANTAGONISTS AND THEIR USE IN TREATMENTS TRPM8, TRPM7, TRPM5 NPC1 533/4885RAB9A 1520/4885GAA 1524/4885
US-10865216-B2 Tricyclic Gyrase inhibitors TOP1, TOP2A, TOP2B NPC1 1992/4885RAB9A 3133/4885GAA 82/4885
US-12030853-B2 MASP-2 inhibitors and methods of use MASP2, METAP2, SPINT2 NPC1 2354/4885RAB9A 2027/4885GAA 1678/4885
US-20120245181-A1 OPIOID RECEPTOR LIGANDS AND METHODS OF USING AND MAKING SAME OPRL1, OPRK1, OPRM1 NPC1 3008/4885RAB9A 3140/4885GAA 3375/4885
US-20210171461-A1 MASP-2 INHIBITORS AND METHODS OF USE MASP2, METAP2, SPINT2 NPC1 2354/4885RAB9A 2027/4885GAA 1678/4885
US-20100267689-A1 4-AZETIDINYL-1-PHENYL-CYCLOHEXANE ANTAGONISTS OF CCR2 CCR2, CCR1, CCR5 NPC1 1303/4885RAB9A 4177/4885GAA 3203/4885

“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.