SCHEMBL7659258

SCHEMBL7659258

O=P(Cc1ccc(CSCc2ccc(Br)cc2F)cc1Br)(OF)OF

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.33
NAAA Q02083 1/20 0.31
AKR1B1 P15121 1/20 0.30

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
SCHEMBL7592732 0.83 PTPN1 (0.35) PTPN1
SCHEMBL7198006 0.80 PTPN1 (0.42) PTPN1
SCHEMBL7663140 0.79 PTPN1 (0.44) PTPN1
SCHEMBL7594291 0.77 PTPN1 (0.34) PTPN1
SCHEMBL7659257 0.76 PTPN1 (0.56) PTPN1
SCHEMBL7193789 0.75 MCHR1 (0.32)
SCHEMBL7596319 0.74 EPHX1 (0.35)
SCHEMBL7659254 0.74 PTPN1 (0.57) PTPN1
SCHEMBL7695855 0.74 PTPN1 (0.32) PTPN1AKR1B1
SCHEMBL7595806 0.74 PTPN1 (0.39) PTPN1

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