SCHEMBL9686440

SCHEMBL9686440

COC(OC)c1cccc2c1sc1ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.43
PARP14 Q460N5 1/20 0.39
ALOX5 P09917 1/20 0.39
MAPT P10636 8/20 0.38
RAB9A P51151 7/20 0.37
ALDH1A1 P00352 6/20 0.37
NPC1 O15118 4/20 0.37
KDM4E B2RXH2 4/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
TDP1 Q9NUW8 1/20 0.37
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
MAPK1 P28482 3/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 5/20 0.35
ALOX15 P16050 2/20 0.35
HSD17B10 Q99714 2/20 0.35
ATM Q13315 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL1102404 0.80 GPR3 (0.48) GPR3PARP14ALOX5MAPTRAB9A
SCHEMBL23056977 0.77 GPR3 (0.45) GPR3PARP14ALOX5MAPTRAB9A
SCHEMBL22161912 0.77 GPR3 (0.45) GPR3PARP14ALOX5MAPTRAB9A
SCHEMBL10015065 0.77 GPR3 (0.48) GPR3PARP14ALOX5MAPTRAB9A
SCHEMBL22924517 0.77 GPR3 (0.48) GPR3PARP14ALOX5MAPTRAB9A
SCHEMBL9963712 0.75 TSHR (0.46) GPR3PARP14ALOX5MAPTRAB9A
SCHEMBL20160627 0.75 TSHR (0.46) GPR3PARP14ALOX5MAPTRAB9A
SCHEMBL17968236 0.74 MAPT (0.54) GPR3MAPTRAB9AALDH1A1NPC1
SCHEMBL3177788 0.73 ALDH1A1 (0.50) MAPTRAB9AALDH1A1NPC1KDM4E
SCHEMBL3295801 0.73 GPR3 (0.48) GPR3MAPTRAB9AALDH1A1NPC1

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-5122442-A Water soluble binder; photosensitive compound HOECHST CELANESE CORPORATION (US) 1992-06-16 US disclosed