SCHEMBL6919739

SCHEMBL6919739

O=C(O)Cc1ccc2oc(-c3ccc(NCC=Cc4ccc(Br)cc4)cc3)nc2c1

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HPSE Q9Y251 20/20 0.77

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
SCHEMBL6920032 0.90 HPSE (0.78) HPSE
SCHEMBL6920173 0.88 HPSE (0.76) HPSE
SCHEMBL6824736 0.87 HPSE (1.00) HPSE
SCHEMBL6818389 0.87 HPSE (1.00) HPSE
SCHEMBL6921476 0.81 HPSE (0.67) HPSE
SCHEMBL6919360 0.81 HPSE (0.80) HPSE
SCHEMBL6920469 0.80 HPSE (0.66) HPSE
SCHEMBL20515142 0.79 HPSE (1.00) HPSE
SCHEMBL6919358 0.78 HPSE (0.69) HPSE
SCHEMBL6822286 0.78 HPSE (0.79) 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