SCHEMBL7659065

SCHEMBL7659065

O=P(O)(O)C(F)(F)c1ccc(CSCCCCCCCO)cc1Br

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 18/20 0.56
PTPN2 P17706 7/20 0.48
PTPRC P08575 2/20 0.41
PTPN6 P29350 1/20 0.36
PTPN11 Q06124 1/20 0.36

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
SCHEMBL7184348 0.90 PTPN1 (0.60) PTPN1PTPN2PTPRC
SCHEMBL7193734 0.89 PTPN1 (0.55) PTPN1PTPN2PTPRC
SCHEMBL7594613 0.87 PTPN1 (0.57) PTPN1PTPN2PTPRCPTPN6PTPN11
SCHEMBL7598941 0.86 PTPN1 (0.53) PTPN1PTPN2PTPRC
SCHEMBL7659253 0.86 PTPN1 (0.70) PTPN1PTPN2PTPRC
SCHEMBL7185375 0.84 PTPN1 (0.54) PTPN1PTPN2PTPRCPTPN6PTPN11
SCHEMBL7187785 0.84 PTPN1 (0.54) PTPN1PTPN2PTPRCPTPN6PTPN11
SCHEMBL7188271 0.82 PTPN1 (0.66) PTPN1PTPN2PTPRC
SCHEMBL7187658 0.82 PTPN1 (0.66) PTPN1PTPN2PTPRC
SCHEMBL7598709 0.82 PTPN1 (0.53) PTPN1PTPN2PTPRCPTPN6PTPN11

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
US-6498151-B2 PROTEIN TYROSINE PHOSPHATASES INHIBITORS, ESPECIALLY AS ANTIDIABETIC AGENTS MERCK FROSST CANADA & CO. (CA) 2002-12-24 US claimed