SCHEMBL9380562

SCHEMBL9380562

Cc1ccn2c(C)c(CCc3ccc4nc(N)oc4c3)nc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.39
RAB9A P51151 5/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
USP2 O75604 1/20 0.39
MAPK10 P53779 1/20 0.39
PIK3CG P48736 1/20 0.37
MAPT P10636 5/20 0.36
KDM4E B2RXH2 5/20 0.36
LCK P06239 1/20 0.35
THRB P10828 1/20 0.34
DNMT1 P26358 1/20 0.34
USP7 Q93009 1/20 0.34
ALDH1A1 P00352 4/20 0.33
POLB P06746 3/20 0.33
HPGD P15428 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
TP53 P04637 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
CYP11B1 P15538 1/20 0.33

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 SCHEMBL9376404 0.99 NPC1 (0.38) NPC1RAB9ASMN1; SMN2USP2MAPK10
SCHEMBL9378810 0.91 PIK3CG (0.37) NPC1RAB9ASMN1; SMN2USP2MAPK10
SCHEMBL9377336 0.89 PIK3CG (0.36) NPC1RAB9ASMN1; SMN2USP2MAPK10
SCHEMBL9376779 0.89 LCK (0.36) NPC1RAB9ASMN1; SMN2USP2MAPK10
SCHEMBL9377550 0.89 PIK3CG (0.41) NPC1RAB9ASMN1; SMN2USP2MAPK10
SCHEMBL9380282 0.89 PIK3CG (0.36) NPC1RAB9ASMN1; SMN2USP2MAPK10
SCHEMBL9378049 0.89 MAPT (0.38) NPC1RAB9ASMN1; SMN2USP2MAPK10
SCHEMBL9375795 0.88 PIK3CG (0.35) NPC1RAB9ASMN1; SMN2USP2MAPK10
SCHEMBL9381311 0.88 SMN1; SMN2 (0.37) NPC1RAB9ASMN1; SMN2USP2MAPK10
SCHEMBL9375319 0.88 PIK3CG (0.38) NPC1RAB9ASMN1; SMN2USP2MAPK10

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
EP-0356234-B1 New Benzazole compounds, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1994-05-11 EP disclosed
US-5047411-A Antiulcer Agents, H2-Receptor Antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-09-10 US disclosed
EP-0356234-A2 New Benzazole compounds, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-02-28 EP disclosed