SCHEMBL10464228

SCHEMBL10464228

CCCCCC(C)(C)c1cc(Cc2cc(CCCC)cc(Cc3cc(C(C)(C)CCCCC)cc(C(=O)O)c3O)c2OC)c(O)c(C(=O)O)c1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 2/20 0.38
▸ PPARG P37231 1/20 0.38
▸ CNR2 P34972 10/20 0.38
▸ CNR1 P21554 10/20 0.38
▸ GPR55 Q9Y2T6 2/20 0.38
▸ GPR18 Q14330 1/20 0.37
▸ AKR1C2 P52895 1/20 0.36
▸ AKR1C1 Q04828 1/20 0.36
▸ KAT8 Q9H7Z6 2/20 0.36
▸ PTGS2 P35354 1/20 0.35
▸ PTPN1 P18031 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ PTPN2 P17706 1/20 0.34
▸ PTPN6 P29350 1/20 0.34

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
SCHEMBL10464227 0.90 AKR1C2 (0.36) PPARAPPARGCNR2AKR1C2AKR1C1
SCHEMBL10519870 0.86 ALDH1A1 (0.45) CNR2CNR1GPR55GPR18PTPN1
SCHEMBL10463841 0.80 CNR2 (0.47) CNR2CNR1GPR55GPR18PTPN1
SCHEMBL10463857 0.79 CNR2 (0.49) CNR2CNR1GPR55GPR18ALDH1A1
SCHEMBL9252811 0.79 CNR1 (0.55) CNR2CNR1GPR55GPR18PTPN1
SCHEMBL10464420 0.78 KAT8 (0.52) PPARAPPARGCNR2CNR1GPR55
SCHEMBL10464424 0.76 HMGB1 (0.43) CNR2CNR1GPR55GPR18PTPN1
SCHEMBL10463908 0.75 ESR1 (0.41) CNR2CNR1GPR55GPR18
SCHEMBL10464428 0.74 CNR2 (0.47) CNR2CNR1GPR55GPR18
SCHEMBL1129774 0.73 CNR2 (0.48) CNR2CNR1

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-4920091-A CONTAINING SALICYLIC ACID DERIVATIVE AS ELECTRON ACCEPTING COLOR DEVELOPER; STABLE IMAGES FUJI PHOTO FILM CO., LTD. (JP) 1990-04-24 — — US disclosed
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