SCHEMBL9418052

SCHEMBL9418052

CCc1nc(=O)c2ccccc2o1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.49
RAB9A P51151 5/20 0.49
ALDH1A1 P00352 4/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
GLA P06280 2/20 0.47
HPGD P15428 2/20 0.46
MAPT P10636 4/20 0.44
KDM4E B2RXH2 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
HSD17B10 Q99714 2/20 0.44
MAOA P21397 2/20 0.44
CYP3A4 P08684 1/20 0.44
PGAM1 P18669 1/20 0.44
CASP1 P29466 1/20 0.44
CASP7 P55210 1/20 0.44
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
MAPK1 P28482 2/20 0.43
PSMD14 O00487 1/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL5707868 0.85 NPC1 (0.55) NPC1RAB9AALDH1A1L3MBTL1GLA
SCHEMBL4536987 0.82 RAB9A (0.52) NPC1RAB9AALDH1A1GLAMAPT
SCHEMBL28568187 0.82 RAB9A (0.49) NPC1RAB9AALDH1A1L3MBTL1GLA
SCHEMBL11715245 0.79 NPC1 (0.46) NPC1RAB9AALDH1A1L3MBTL1GLA
SCHEMBL6448403 0.78 NPC1 (0.45) NPC1RAB9AALDH1A1L3MBTL1GLA
SCHEMBL2882726 0.77 NPC1 (0.58) NPC1RAB9AALDH1A1L3MBTL1GLA
SCHEMBL3533214 0.76 KDM4E (0.57) NPC1RAB9AALDH1A1L3MBTL1GLA
SCHEMBL8443182 0.75 ALDH1A1 (0.47) NPC1RAB9AALDH1A1L3MBTL1GLA
SCHEMBL3787635 0.73 NPC1 (0.44) NPC1RAB9AALDH1A1L3MBTL1GLA
SCHEMBL2621291 0.73 MAPT (0.70) NPC1RAB9AALDH1A1MAPTSMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-6247946-A None JP disclosed
JP-H06247946-A PRODUCTION OF 4-OXO-1,3-BENZOXAZINE COMPOUNDS SHIRATORI SEIYAKU KK 1994-09-06 JP disclosed