SCHEMBL6268296

SCHEMBL6268296

Cc1cc(C)c(NC(=O)C(Oc2cccc(-c3sc(C(=O)O)c(OCC(=O)O)c3Br)c2)C2CCNCC2)c(C)c1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 20/20 0.58
PTPN2 P17706 2/20 0.51

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
SCHEMBL6268874 0.91 PTPN1 (0.46) PTPN1PTPN2
SCHEMBL3916576 0.90 PTPN1 (0.58) PTPN1PTPN2
SCHEMBL3909385 0.89 PTPN1 (0.66) PTPN1PTPN2
SCHEMBL6263333 0.88 PTPN1 (0.49) PTPN1PTPN2
SCHEMBL3908835 0.87 PTPN1 (0.62) PTPN1PTPN2
SCHEMBL6275074 0.87 PTPN1 (0.48) PTPN1PTPN2
SCHEMBL6263895 0.86 PTPN1 (0.58) PTPN1PTPN2
SCHEMBL6265051 0.86 PTPN1 (0.56) PTPN1PTPN2
SCHEMBL3908273 0.85 PTPN1 (0.62) PTPN1PTPN2
SCHEMBL6263173 0.85 PTPN1 (0.58) PTPN1PTPN2

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