SCHEMBL4785652

SCHEMBL4785652

Cc1ccc(Cc2ccc(N3CC(=O)NS3(=O)=O)c(O)c2)c(CS(N)(=O)=O)c1

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 14/20 0.56
PTPN2 P17706 11/20 0.35

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
SCHEMBL3208657 0.87 PTPN1 (0.58) PTPN1PTPN2
SCHEMBL2935550 0.86 PTPN1 (0.55) PTPN1PTPN2
SCHEMBL647600 0.85 PTPN1 (0.56) PTPN1PTPN2
SCHEMBL2935548 0.83 PTPN1 (0.53) PTPN1PTPN2
SCHEMBL648320 0.83 PTPN1 (0.57) PTPN1PTPN2
SCHEMBL648667 0.83 PTPN1 (0.67) PTPN1PTPN2
SCHEMBL647121 0.83 PTPN1 (0.57) PTPN1PTPN2
SCHEMBL648982 0.83 PTPN1 (0.67) PTPN1PTPN2
SCHEMBL647669 0.82 PTPN1 (0.56) PTPN1PTPN2
SCHEMBL12971485 0.82 PTPN1 (0.54) 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-2008067527-A1 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE FOR THE TREATMENT OF MUSCLE ATROPHY AND RELATED DISORDERS NOVARTIS AG (CH) 2008-06-05 WO disclosed