SCHEMBL9868913

SCHEMBL9868913

COc1ccc(-c2nc3ncc(Cl)cc3o2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.46
RAB9A P51151 6/20 0.46
SMN1; SMN2 Q16637 5/20 0.46
MAPT P10636 7/20 0.46
TP53 P04637 3/20 0.46
ALDH1A1 P00352 3/20 0.45
KDM4E B2RXH2 3/20 0.45
MEN1 O00255 2/20 0.45
HPGD P15428 2/20 0.45
KMT2A Q03164 2/20 0.45
MAPK1 P28482 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
CETP P11597 1/20 0.45
LMNA P02545 2/20 0.45
POLB P06746 1/20 0.45
APP P05067 2/20 0.43
HDAC6 Q9UBN7 2/20 0.43
KDR P35968 1/20 0.43
GAA P10253 1/20 0.42
CA1 P00915 1/20 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
SCHEMBL9868637 0.85 SMN1; SMN2 (0.45) NPC1RAB9ASMN1; SMN2MAPTTP53
SCHEMBL9866308 0.78 CETP (0.43) NPC1RAB9ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL22259813 0.76 MAPT (0.42) MAPTTP53POLB
SCHEMBL9867789 0.75 MAPT (0.70) NPC1RAB9ASMN1; SMN2MAPTTP53
SCHEMBL31631303 0.72 NPC1 (0.64) NPC1RAB9ASMN1; SMN2MAPTTP53
SCHEMBL27075892 0.71 CHRNA7 (0.47) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL30648212 0.71 CHRNA7 (0.47) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL12639218 0.71 MAPT (0.62) NPC1RAB9ASMN1; SMN2MAPTTP53
SCHEMBL2953614 0.71 MAPT (0.50) NPC1RAB9ASMN1; SMN2MAPTTP53
SCHEMBL12639220 0.70 NPC1 (0.68) NPC1RAB9ASMN1; SMN2MAPTTP53

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
US-5077408-A PROCESS FOR THE SYNTHESIS OF OXAZOLOPYRIDINE COMPOUNDS SCIENCE ET ORGANISATION (FR) 1991-12-31 US disclosed