SCHEMBL8185754

SCHEMBL8185754

COc1ccc(C(=O)Nc2c(-c3ccccc3C)nc3c4ccccc4ccn23)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.52
RAB9A P51151 3/20 0.52
KMT2A Q03164 2/20 0.52
RXFP1 Q9HBX9 1/20 0.49
GAA P10253 1/20 0.46
F10 P00742 1/20 0.44
POLB P06746 1/20 0.44
PARP14 Q460N5 1/20 0.44
GPR35 Q9HC97 1/20 0.44
ADORA3 P0DMS8 2/20 0.43
MAPT P10636 3/20 0.42
KCNJ11 Q14654 1/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
LMNA P02545 2/20 0.42
MAPK1 P28482 1/20 0.42
STK33 Q9BYT3 1/20 0.42
ABCB1 P08183 1/20 0.42
ABCG2 Q9UNQ0 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41

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
SCHEMBL8173245 0.82 ALDH1A1 (0.50) NPC1RAB9AKMT2ARXFP1GAA
SCHEMBL8185832 0.79 KMT2A (0.48) NPC1RAB9AKMT2AGAAPOLB
SCHEMBL8186944 0.78 RAB9A (0.48) NPC1RAB9AKMT2ARXFP1POLB
SCHEMBL8182675 0.77 MAPT (0.43) RAB9AKMT2ARXFP1GAAPARP14
SCHEMBL8208278 0.75 RAB9A (0.36) RAB9AKMT2ARXFP1MAPTKDM4E
SCHEMBL8173367 0.75 MAPT (0.41) NPC1RAB9AKMT2ARXFP1GAA
SCHEMBL8186948 0.75 SOAT1 (0.42) NPC1RAB9AKMT2AGAAMAPT
SCHEMBL8173360 0.75 CYP1A2 (0.47) NPC1RAB9AKMT2ARXFP1GAA
SCHEMBL8183165 0.73 GCGR (0.39) NPC1RAB9AKMT2ARXFP1PARP14
SCHEMBL8189247 0.73 NR1H4 (0.42) NPC1RAB9AKMT2ARXFP1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6103736-A SHOWING AN INHIBITORY ACTION ON GASTRIC ACID SECRETION AND A PROTECTIVE ACTION OF GASTRIC MUCOSA; 2-(HETERO)ARYL-3-AMINOIMIDAZO-(2,1-A)ISOQUINOLINES; ANTIULCER AGENTS; SHINNIPPON PHARMACEUTICAL INC. (JP) 2000-08-15 US disclosed
US-6020342-A Fused imidazo[1,2-A]pyridines SHINNIPPON PHARMACEUTICAL, INC. (JP) 2000-02-01 US disclosed
EP-0822194-A1 FUSED IMIDAZO 1,2-a]PYRIDINES Shinnippon Pharmaceutical Inc. (JP) 1998-02-04 EP disclosed