SCHEMBL10464424

SCHEMBL10464424

CCCCCC(C)(C)c1cc(Cc2cc(C)cc(Cc3cc(C)c(O)c(C)c3)c2O)c(O)c(C(=O)O)c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HMGB1 P09429 1/20 0.43
▸ CXCL12 P48061 1/20 0.43
▸ CNR2 P34972 15/20 0.41
▸ CNR1 P21554 11/20 0.41
▸ GPR18 Q14330 2/20 0.39
▸ GPR55 Q9Y2T6 2/20 0.39
▸ PTPN1 P18031 2/20 0.38
▸ PTPN2 P17706 1/20 0.38
▸ PTPN6 P29350 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ HIF1A Q16665 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
SCHEMBL10463841 0.92 CNR2 (0.47) CNR2CNR1GPR18GPR55PTPN1
SCHEMBL10463857 0.91 CNR2 (0.49) CNR2CNR1GPR18GPR55ALDH1A1
SCHEMBL10519870 0.87 ALDH1A1 (0.45) CNR2CNR1GPR18GPR55PTPN1
SCHEMBL10464428 0.85 CNR2 (0.47) CNR2CNR1GPR18GPR55
SCHEMBL10464422 0.85 HMGB1 (0.47) HMGB1CXCL12PTPN1PTPN2PTPN6
SCHEMBL9252811 0.82 CNR1 (0.55) CNR2CNR1GPR18GPR55PTPN1
SCHEMBL1129774 0.82 CNR2 (0.48) HMGB1CXCL12CNR2CNR1
SCHEMBL5885489 0.81 CNR2 (0.50) HMGB1CXCL12CNR2CNR1GPR18
SCHEMBL3008861 0.81 CNR2 (0.50) HMGB1CXCL12CNR2CNR1GPR18
SCHEMBL10464280 0.80 HMGB1 (0.47) HMGB1CXCL12CNR2CNR1GPR18

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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