SCHEMBL6507341

SCHEMBL6507341

Cc1cc(N(C(=O)c2ccc3c(OCC(=O)O)c(C(=O)O)sc3c2)c2ccccc2)n[nH]1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 18/20 0.40
PTPN2 P17706 4/20 0.40
PTPRC P08575 3/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.34
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL6507339 0.82 PTPN1 (0.37) PTPN1PTPN2PTPRC
SCHEMBL4118684 0.77 PTPN1 (0.46) PTPN1PTPN2PTPRCPTGDR2
SCHEMBL4119518 0.75 DYRK1A (0.51) PTPN1PTPN2PTPRC
SCHEMBL4132071 0.75 PTPN1 (0.42) PTPN1PTPN2PTPRC
SCHEMBL4120133 0.74 PTPN1 (0.49) PTPN1PTPN2PTPRC
SCHEMBL4127309 0.71 PTPN1 (0.49) PTPN1PTPN2PTPRC
SCHEMBL13926050 0.71 MCL1 (0.57) PTPN1PTPN2PTPRCPTGDR2MAPT
SCHEMBL4132062 0.70 PTPN1 (0.47) PTPN1PTPN2PTPRC
SCHEMBL4125935 0.70 PTPN1 (0.45) PTPN1PTPN2PTPRC
SCHEMBL4125928 0.70 PTPN1 (0.45) PTPN1PTPN2PTPRC

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-2005081960-A2 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE 1B WYETH (US) 2005-09-09 WO disclosed