SCHEMBL6267335

SCHEMBL6267335

Cc1c(-c2cccc(N(C3CCNCC3)S(=O)(=O)Cc3ccc(Cl)c(Cl)c3)c2)sc(C(=O)O)c1OCC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 20/20 0.48
PTPN2 P17706 6/20 0.41
PTPRC P08575 1/20 0.39
CYP2C9 P11712 1/20 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
SCHEMBL6268229 0.93 PTPN1 (0.51) PTPN1PTPN2PTPRCCYP2C9
SCHEMBL6263477 0.93 PTPN1 (0.49) PTPN1PTPN2PTPRCCYP2C9
SCHEMBL3910292 0.91 PTPN1 (0.57) PTPN1PTPN2PTPRCCYP2C9
SCHEMBL3910937 0.90 PTPN1 (0.51) PTPN1PTPN2PTPRCCYP2C9
SCHEMBL6261292 0.88 PTPN1 (0.46) PTPN1PTPN2
SCHEMBL6263395 0.88 PTPN1 (0.49) PTPN1PTPN2PTPRCCYP2C9
SCHEMBL6269648 0.88 PTPN1 (0.51) PTPN1PTPN2PTPRC
SCHEMBL6263620 0.88 PTPN1 (0.48) PTPN1PTPN2PTPRCCYP2C9
SCHEMBL6265788 0.87 PTPN1 (0.49) PTPN1PTPN2PTPRCCYP2C9
SCHEMBL6268098 0.86 PTPN1 (0.53) PTPN1PTPN2PTPRCCYP2C9

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