SCHEMBL10959632

SCHEMBL10959632

COc1ccc(Cc2[nH]cnc2-c2cccs2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.50
RAB9A P51151 5/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
PKM P14618 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
PDE10A Q9Y233 1/20 0.43
TSHR P16473 2/20 0.42
NR1H4 Q96RI1 2/20 0.42
ABL1 P00519 1/20 0.42
ALDH1A1 P00352 7/20 0.41
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
USP2 O75604 4/20 0.41
KDM4E B2RXH2 3/20 0.41
HSD17B10 Q99714 3/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
DNMT1 P26358 1/20 0.41
PTPN7 P35236 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
SCHEMBL10959629 0.77 PDE10A (0.59) NPC1RAB9ASMN1; SMN2PKML3MBTL1
SCHEMBL11485920 0.68 MAPT (0.42) NPC1RAB9ASMN1; SMN2L3MBTL1TDP1
SCHEMBL546118 0.68 L3MBTL1 (0.57) NPC1RAB9ASMN1; SMN2PKML3MBTL1
SCHEMBL6453590 0.66 MAPT (0.43) SMN1; SMN2L3MBTL1TDP1ALDH1A1MEN1
SCHEMBL21313236 0.66 ALDH1A1 (0.51) NPC1RAB9ASMN1; SMN2PKML3MBTL1
SCHEMBL558329 0.65 LTA4H (0.56) NPC1RAB9ASMN1; SMN2PKMALDH1A1
SCHEMBL23951 0.65 MAPT (0.59) NPC1RAB9ASMN1; SMN2PKML3MBTL1
SCHEMBL13510673 0.64 PDE10A (0.52) NPC1RAB9ASMN1; SMN2PKML3MBTL1
SCHEMBL704825 0.64 PDE10A (0.59) NPC1RAB9ASMN1; SMN2PKML3MBTL1
SCHEMBL28486325 0.64 MAPT (0.58) NPC1RAB9ASMN1; SMN2PKML3MBTL1

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-4524123-A POLYETHERSILOXANE COPOLYMERS, HIGH MOLECULAR WEIGHT POLYETHYLEN, AND EMULSIFIER AGFA-GEVAERT AKTIENGESELLSCHAFT (DE) 1985-06-18 US disclosed