SCHEMBL7567740

SCHEMBL7567740

Cc1ccsc1CC(=O)Nc1ncccc1C(=O)Cl

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
NPC1 O15118 2/20 0.39
MEN1 O00255 1/20 0.39
RAB9A P51151 1/20 0.39
MAPK8 P45983 3/20 0.39
MAPK9 P45984 2/20 0.39
MAPK10 P53779 2/20 0.39
FFAR2 O15552 1/20 0.38
P2RX7 Q99572 1/20 0.38
HTT P42858 1/20 0.38
KDM4E B2RXH2 1/20 0.37
KDM6B O15054 1/20 0.37
KDM4A O75164 1/20 0.37
KDM5C P41229 1/20 0.37
KDM4D Q6B0I6 1/20 0.37
KDM4C Q9H3R0 1/20 0.37
SLCO1B1 Q9Y6L6 1/20 0.37

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
SCHEMBL8798277 0.83 NPC1 (0.41) KMT2AL3MBTL1NPC1MEN1RAB9A
SCHEMBL7570572 0.75 NAMPT (0.55) KMT2AL3MBTL1NPC1MEN1RAB9A
SCHEMBL7505880 0.74 SGMS2 (0.45) KMT2AL3MBTL1NPC1MEN1RAB9A
SCHEMBL5234312 0.72 RAB9A (0.44) KMT2AL3MBTL1NPC1MEN1RAB9A
SCHEMBL7493834 0.71 KMT2A (0.65) KMT2AL3MBTL1NPC1MEN1RAB9A
SCHEMBL7578693 0.69 L3MBTL1 (0.51) KMT2AL3MBTL1NPC1MEN1RAB9A
SCHEMBL8573120 0.68 ALOX5 (0.47) KDM4EKDM6BKDM4AKDM5CKDM4D
SCHEMBL10345079 0.68 ALOX5 (0.47) KMT2AMEN1KDM4EKDM6BKDM4A
SCHEMBL11433211 0.68 ALOX5 (0.50) KMT2AKDM4EKDM6BKDM4AKDM5C
SCHEMBL8797776 0.68 KMT2A (0.52) KMT2AL3MBTL1NPC1MEN1RAB9A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1997049708-A1 TRICYCLIC BENZAZEPINE VASOPRESSIN ANTAGONISTS AMERICAN CYANAMID COMPANY (US) 1997-12-31 WO disclosed