SCHEMBL7650125

SCHEMBL7650125

CN(C(=O)c1ccc(N(C)C(=O)c2ccc(C(=O)O)cc2)cc1)c1ccc(/C=C/c2ccc(O)c(C(=O)O)c2)cc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.61
PTPN2 P17706 1/20 0.61
PTPN6 P29350 1/20 0.61
HNF4A P41235 1/20 0.57
PTGS2 P35354 1/20 0.52
LCK P06239 1/20 0.49
APP P05067 6/20 0.48
DHODH Q02127 1/20 0.48
HSP90AA1 P07900 1/20 0.44
PDK2 Q15119 1/20 0.44
RARA P10276 2/20 0.43
RARB P10826 2/20 0.43
RARG P13631 2/20 0.43
PIM1 P11309 1/20 0.43
CSNK2A1 P68400 1/20 0.42
CXCL12 P48061 1/20 0.41

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
SCHEMBL7531123 0.93 PTPN1 (0.53) PTPN1PTPN2PTPN6HNF4APTGS2
SCHEMBL7523901 0.84 PTPN1 (0.47) PTPN1PTPN2PTPN6HNF4AAPP
SCHEMBL7531117 0.83 PTPN1 (0.63) PTPN1PTPN2PTPN6HNF4APTGS2
SCHEMBL7531126 0.83 PTPN1 (0.63) PTPN1PTPN2PTPN6HNF4APTGS2
SCHEMBL12881125 0.82 PTPN1 (0.75) PTPN1PTPN2PTPN6HNF4APTGS2
SCHEMBL7646325 0.81 APP (0.41) PTPN1PTPN2PTPN6HNF4APTGS2
SCHEMBL7528663 0.79 SNCA (0.49) PTPN1HNF4AAPPDHODH
SCHEMBL6266629 0.78 PTPN1 (1.00) PTPN1PTPN2PTPN6HNF4APTGS2
SCHEMBL6266631 0.78 PTPN1 (1.00) PTPN1PTPN2PTPN6HNF4APTGS2
SCHEMBL1048686 0.78 PTPN1 (1.00) PTPN1PTPN2PTPN6HNF4APTGS2

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-6479548-B2 P-(BENZOYLAMINO)STILBENE DERIVATIVES TELIK, INC. 2002-11-12 US disclosed