SCHEMBL9520641

SCHEMBL9520641

COc1ccccc1C(=C/C=C/C(=O)NCCCCc1cccnc1)c1ccccc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 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
SCHEMBL9520653 1.00 PTAFR (1.00) PTAFR
SCHEMBL10399103 0.94 PTAFR (0.90) PTAFR
SCHEMBL10399106 0.94 PTAFR (0.90) PTAFR
SCHEMBL9519892 0.92 PTAFR (0.85) PTAFR
SCHEMBL9521726 0.92 PTAFR (0.85) PTAFR
SCHEMBL9519898 0.92 PTAFR (0.85) PTAFR
SCHEMBL10399204 0.89 PTAFR (0.80) PTAFR
SCHEMBL10399206 0.89 PTAFR (0.80) PTAFR
SCHEMBL9521355 0.85 PTAFR (1.00) PTAFR
SCHEMBL9521367 0.85 PTAFR (1.00) PTAFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0299379-B1 PENTADIENAMIDE PAF-ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 1993-04-21 EP disclosed
US-4975438-A ANTICOAGULANT HOFFMANN-LA ROCHE INC. (US) 1990-12-04 US disclosed
EP-0299379-A1 Pentadienamide PAF-antagonists F. HOFFMANN-LA ROCHE AG (CH) 1989-01-18 EP disclosed
US-4788206-A CARDIOVASCULAR DISORDERS, PLATELETS HOFFMANN-LA ROCHE INC. (US) 1988-11-29 US disclosed