SCHEMBL5768084

SCHEMBL5768084

[c]1ccc(-c2ccc(-c3c(Cc4ccccc4)oc4ccccc34)cc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 20/20 0.72
PTPRF P10586 1/20 0.56
PTPRA P18433 1/20 0.56
PTPN7 P35236 1/20 0.56
DUSP3 P51452 1/20 0.56

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
SCHEMBL5743653 0.90 PTPN1 (0.83) PTPN1PTPRFPTPRAPTPN7DUSP3
SCHEMBL7497194 0.84 PTPN1 (1.00) PTPN1PTPRFPTPRAPTPN7DUSP3
SCHEMBL3867351 0.83 PTPN1 (0.77) PTPN1PTPRFPTPRAPTPN7DUSP3
SCHEMBL13888092 0.83 PTPN1 (0.72) PTPN1PTPRFPTPRAPTPN7DUSP3
SCHEMBL3868415 0.82 PTPN1 (0.97) PTPN1PTPRFPTPRAPTPN7DUSP3
SCHEMBL3871852 0.82 PTPN1 (0.71) PTPN1PTPRFPTPRAPTPN7DUSP3
SCHEMBL4478559 0.81 PTPN1 (0.79) PTPN1PTPRFPTPRAPTPN7DUSP3
SCHEMBL7597537 0.78 PTPN1 (0.72) PTPN1PTPRFPTPRAPTPN7DUSP3
SCHEMBL7504747 0.78 PTPN1 (0.72) PTPN1PTPRFPTPRAPTPN7DUSP3
SCHEMBL4459365 0.78 PTPN1 (0.68) PTPN1PTPRFPTPRAPTPN7DUSP3

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2006525329-A 2006-11-09 JP claimed
EP-1620420-A2 SUBSTITUTED CARBOXYLIC ACIDS The Institutes for Pharmaceutical Discovery, LLC (US) 2006-02-01 EP claimed
WO-2004099168-A2 SUBSTITUTED CARBOXYLIC ACIDS THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY, LLC (US) 2004-11-18 WO claimed
EP-1620420-A2 SUBSTITUTED CARBOXYLIC ACIDS The Institutes for Pharmaceutical Discovery, LLC (US) 2006-02-01 EP disclosed
WO-2004099168-A2 SUBSTITUTED CARBOXYLIC ACIDS THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY, LLC (US) 2004-11-18 WO disclosed