SCHEMBL6262160

SCHEMBL6262160

O=C(O)CCOc1c(C(=O)O)sc(Br)c1Br

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 18/20 0.71
PTPRC P08575 3/20 0.44
PTPN2 P17706 3/20 0.44
GPR35 Q9HC97 2/20 0.39

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
SCHEMBL3903300 0.83 PTPN1 (1.00) PTPN1PTPRCPTPN2
SCHEMBL476321 0.73 PTPN1 (0.61) PTPN1PTPRCPTPN2GPR35
SCHEMBL6266960 0.72 PTPN1 (0.68) PTPN1PTPRCPTPN2GPR35
SCHEMBL6262341 0.70 PTPN1 (0.76) PTPN1PTPRCPTPN2
SCHEMBL3907174 0.70 PTPN1 (0.76) PTPN1PTPRCPTPN2
SCHEMBL3913634 0.69 PTPN1 (0.56) PTPN1PTPRCPTPN2GPR35
SCHEMBL6267108 0.69 PTPN1 (0.75) PTPN1PTPRCPTPN2
SCHEMBL3906716 0.68 PTPN1 (0.71) PTPN1PTPRCPTPN2
SCHEMBL6262512 0.67 PTPN1 (0.40) PTPN1
SCHEMBL4582179 0.67 GPR35 (0.54) PTPN1PTPRCPTPN2GPR35

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
WO-2005081954-A2 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE 1B WYETH (US) 2005-09-09 WO disclosed