SCHEMBL9505723

SCHEMBL9505723

Cc1ccccc1Cc1cc(C(=O)O)c(O)c(C(C)c2ccccc2Cc2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 5/20 0.54
PTPN2 P17706 2/20 0.54
PTPN6 P29350 2/20 0.54
HMGB1 P09429 2/20 0.46
CXCL12 P48061 2/20 0.46
LDHA P00338 3/20 0.45
LDHB P07195 3/20 0.45
HNF4A P41235 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
TSHR P16473 1/20 0.38
CNR2 P34972 1/20 0.38
GPR55 Q9Y2T6 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL9509619 0.85 PTPN1 (0.50) PTPN1PTPN2PTPN6HMGB1CXCL12
SCHEMBL9509289 0.84 PTPN1 (0.52) PTPN1PTPN2PTPN6HMGB1CXCL12
SCHEMBL10583340 0.82 PTPN1 (0.49) PTPN1PTPN2PTPN6HMGB1CXCL12
SCHEMBL9652715 0.80 PTPN1 (0.58) PTPN1PTPN2PTPN6HMGB1CXCL12
SCHEMBL6369577 0.79 HMGB1 (0.73) PTPN1PTPN2PTPN6HMGB1CXCL12
SCHEMBL8428416 0.79 PTPN1 (0.46) PTPN1PTPN2PTPN6HMGB1CXCL12
SCHEMBL29688190 0.78 PTPN1 (0.72) PTPN1PTPN2PTPN6HMGB1CXCL12
SCHEMBL1395559 0.78 PTPN1 (0.72) PTPN1PTPN2PTPN6HMGB1CXCL12
SCHEMBL9652710 0.78 PTPN1 (0.63) PTPN1PTPN2PTPN6HMGB1CXCL12
SCHEMBL8758417 0.77 PTPN1 (0.70) PTPN1PTPN2PTPN6HMGB1CXCL12

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
EP-0322091-B1 PROCESS FOR PREPARING ZINC SALT OF SALICYCLIC ACID COMPOUND Fuji Photo Film Co., Ltd. (JP) 1993-08-11 EP disclosed