SCHEMBL10464292

SCHEMBL10464292

CCCCCCOc1c(Cc2cc(C)c(O)c(C(=O)O)c2)cc(Cc2cc(C)c(O)c(C(=O)O)c2)cc1C(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HMGB1 P09429 1/20 0.51
▸ CXCL12 P48061 1/20 0.51
▸ PTPN1 P18031 2/20 0.39
▸ PTPN2 P17706 1/20 0.39
▸ PTPN6 P29350 1/20 0.39
▸ ESR1 P03372 1/20 0.38
▸ SCN2A Q99250 2/20 0.37
▸ THRA P10827 2/20 0.37
▸ THRB P10828 2/20 0.37
▸ S1PR2 O95136 1/20 0.36
▸ S1PR1 P21453 1/20 0.36
▸ S1PR3 Q99500 1/20 0.36
▸ LPAR2 Q9HBW0 1/20 0.36
▸ RXRA P19793 1/20 0.36
▸ PPARG P37231 1/20 0.36
▸ KAT8 Q9H7Z6 2/20 0.36

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
SCHEMBL14124050 0.77 HMGB1 (0.76) HMGB1CXCL12PTPN1PTPN2PTPN6
SCHEMBL10464280 0.77 HMGB1 (0.47) HMGB1CXCL12
SCHEMBL9755153 0.71 HMGB1 (1.00) HMGB1CXCL12PTPN1PTPN2PTPN6
SCHEMBL15861939 0.71 PLA2G2A (0.43) THRATHRBS1PR3
SCHEMBL7782524 0.71 HMGB1 (0.63) HMGB1CXCL12PPARGKAT8
SCHEMBL7783721 0.71 HMGB1 (0.63) HMGB1CXCL12PPARGKAT8
SCHEMBL334544 0.71 HMGB1 (0.63) HMGB1CXCL12PPARGKAT8
SCHEMBL11778156 0.70 HMGB1 (0.61) HMGB1CXCL12PTPN1PTPN2PTPN6
SCHEMBL10463125 0.70 KAT8 (0.57) PTPN1PTPN6THRATHRBS1PR3
SCHEMBL10461267 0.70 KAT8 (0.57) PTPN1PTPN6THRATHRBS1PR3

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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