SCHEMBL6821867

SCHEMBL6821867

O=C(O)Cc1ccc2oc(-c3ccc(NC(=O)C=Cc4ccc(F)cc4F)c(F)c3)nc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HPSE Q9Y251 20/20 1.00

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
SCHEMBL7129955 0.93 HPSE (0.88) HPSE
SCHEMBL6822223 0.90 HPSE (0.90) HPSE
SCHEMBL6821358 0.90 HPSE (0.84) HPSE
SCHEMBL6821864 0.89 HPSE (0.82) HPSE
SCHEMBL6818510 0.87 HPSE (1.00) HPSE
SCHEMBL6821029 0.86 HPSE (1.00) HPSE
SCHEMBL6921209 0.86 HPSE (0.76) HPSE
SCHEMBL20280936 0.86 HPSE (1.00) HPSE
SCHEMBL29424176 0.86 HPSE (1.00) HPSE
SCHEMBL6818620 0.86 HPSE (0.80) HPSE

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
WO-2004046122-A2 BENZOXAZOLE, BENZTHIAZOLE AND BENZIMIDAZOLE ACID DERIVATIVES AND THEIR USE AS HEPARANASE INHIBITORS OXFORD GLYCOSCIENCES (UK) LTD (GB) 2004-06-03 WO disclosed