SCHEMBL7660739

SCHEMBL7660739

O=P(Cc1ccc(CSCc2ccc(C(F)(F)P(=O)(O)O)cc2)cc1)(OF)OF

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PGK1 P00558 3/20 0.59
▸ PGK2 P07205 3/20 0.59
▸ PTPN1 P18031 15/20 0.51
▸ PTPN2 P17706 5/20 0.51
▸ PTPN6 P29350 5/20 0.51
▸ PTPN11 Q06124 4/20 0.51
▸ PTPRB P23467 3/20 0.50
▸ PTPRC P08575 3/20 0.50
▸ CDC25A P30304 1/20 0.50
▸ PTPN5 P54829 1/20 0.43

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
SCHEMBL7591720 0.99 PGK1 (0.57) PGK1PGK2PTPN1PTPN2PTPN6
SCHEMBL7179735 0.89 PTPN1 (0.56) PGK1PGK2PTPN1PTPN2PTPN6
SCHEMBL7660736 0.87 PGK1 (0.67) PGK1PGK2PTPN1PTPN2PTPN6
SCHEMBL7591715 0.85 PGK1 (0.64) PGK1PGK2PTPN1PTPN2PTPN6
SCHEMBL7183073 0.85 PGK1 (0.40) PGK1PGK2PTPN1PTPN2PTPN6
SCHEMBL4316972 0.84 PTPN1 (0.74) PGK1PGK2PTPN1PTPN2PTPN6
SCHEMBL5163594 0.83 PGK1 (0.59) PGK1PGK2PTPN1PTPN2PTPN6
SCHEMBL7188019 0.82 PGK1 (0.57) PGK1PGK2PTPN1PTPN2PTPN6
SCHEMBL5892025 0.81 PGK1 (0.56) PGK1PGK2PTPN1PTPN2PTPN6
SCHEMBL5003956 0.78 PTPN1 (0.67) PGK1PGK2PTPN1PTPN2PTPN6

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
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