SCHEMBL10237063

SCHEMBL10237063

C#Cc1ccc(-c2cc(NP(=O)(OCC)c3ccc(Cl)cc3Cl)c(C(=O)OC)s2)cc1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 1/20 0.48
▸ MAPT P10636 2/20 0.47
▸ TP53 P04637 1/20 0.47
▸ KDM4E B2RXH2 3/20 0.43
▸ NPSR1 Q6W5P4 2/20 0.43
▸ KMT2A Q03164 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
SCHEMBL10237263 0.92 RXFP1 (0.49) RXFP1MAPTTP53KDM4ENPSR1
SCHEMBL10237067 0.92 PTPN1 (0.41) —
SCHEMBL10237218 0.89 RXFP1 (0.48) RXFP1MAPTKDM4ENPSR1
SCHEMBL10237256 0.88 MAPT (0.55) RXFP1MAPTTP53KDM4ENPSR1
SCHEMBL10237267 0.85 PTPN1 (0.41) —
SCHEMBL10237244 0.85 RXFP1 (0.44) RXFP1MAPTTP53
SCHEMBL10279152 0.84 MAPT (0.45) RXFP1MAPTTP53
SCHEMBL10279684 0.84 RXFP1 (0.46) RXFP1MAPTTP53KDM4ENPSR1
SCHEMBL10237268 0.84 PTPN1 (0.49) —
SCHEMBL10236447 0.81 — —

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-8193372-B2 Phosphothiophene and phosphothiazole HCV polymerase inhibitors IDENIX PHARMACEUTICALS, INC. (US) 2012-06-05 — — US disclosed
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