SCHEMBL7665252

SCHEMBL7665252

O=C(CSCc1ccc(C(F)(F)P(=O)(O)O)c(Br)c1)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 15/20 0.58
PTPN2 P17706 6/20 0.58
PTPRC P08575 2/20 0.42
ALDH1A1 P00352 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL7194696 0.87 PTPN1 (0.64) PTPN1PTPN2PTPRCMEN1KMT2A
SCHEMBL7187658 0.86 PTPN1 (0.66) PTPN1PTPN2PTPRC
SCHEMBL7599748 0.85 PTPN1 (0.65) PTPN1PTPN2PTPRC
SCHEMBL7659253 0.85 PTPN1 (0.70) PTPN1PTPN2PTPRC
SCHEMBL7198002 0.83 PTPN1 (0.72) PTPN1PTPN2PTPRC
SCHEMBL7595795 0.82 PTPN1 (0.59) PTPN1PTPN2PTPRCMEN1KMT2A
SCHEMBL7188271 0.81 PTPN1 (0.66) PTPN1PTPN2PTPRCMEN1KMT2A
SCHEMBL7183004 0.80 PTPN1 (0.65) PTPN1PTPN2PTPRCMEN1KMT2A
SCHEMBL7188307 0.80 PTPN1 (0.59) PTPN1PTPN2PTPRC
SCHEMBL7599145 0.80 PTPN1 (0.61) 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
US-6498151-B2 PROTEIN TYROSINE PHOSPHATASES INHIBITORS, ESPECIALLY AS ANTIDIABETIC AGENTS MERCK FROSST CANADA & CO. (CA) 2002-12-24 US claimed