SCHEMBL7659254

SCHEMBL7659254

O=P(O)(O)C(F)(F)c1ccc(CSCc2ccc(Br)cc2F)cc1Br

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 18/20 0.57
PTPN2 P17706 5/20 0.44
PTPRC P08575 2/20 0.40
EPM2A O95278 1/20 0.37
PTPN22 Q9Y2R2 1/20 0.37
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 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
SCHEMBL7188007 0.88 PTPN1 (0.59) PTPN1PTPN2PTPRC
SCHEMBL7188271 0.88 PTPN1 (0.66) PTPN1PTPN2PTPRCMEN1KMT2A
SCHEMBL7183004 0.87 PTPN1 (0.65) PTPN1PTPN2PTPRCMEN1KMT2A
SCHEMBL7659253 0.87 PTPN1 (0.70) PTPN1PTPN2PTPRC
SCHEMBL7187515 0.84 PTPN1 (0.57) PTPN1PTPN2PTPRC
SCHEMBL7595441 0.83 PTPN1 (0.61) PTPN1PTPN2PTPRCKMT2A
SCHEMBL7599145 0.83 PTPN1 (0.61) PTPN1PTPN2PTPRC
SCHEMBL7186859 0.83 PTPN1 (0.56) PTPN1PTPN2PTPRC
SCHEMBL7193728 0.83 PTPN1 (0.64) PTPN1PTPN2PTPRC
SCHEMBL7193731 0.83 PTPN1 (0.64) 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 2 patents. 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
US-6498151-B2 PROTEIN TYROSINE PHOSPHATASES INHIBITORS, ESPECIALLY AS ANTIDIABETIC AGENTS MERCK FROSST CANADA & CO. (CA) 2002-12-24 US disclosed