SCHEMBL10399206

SCHEMBL10399206

COc1ccccc1C(=CC=CC(=O)NCCCCc1cccnc1)c1cccc(F)c1

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 20/20 0.80

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
SCHEMBL10399204 1.00 PTAFR (0.80) PTAFR
SCHEMBL10399103 0.91 PTAFR (0.90) PTAFR
SCHEMBL10399106 0.91 PTAFR (0.90) PTAFR
SCHEMBL9520653 0.89 PTAFR (1.00) PTAFR
SCHEMBL9520641 0.89 PTAFR (1.00) PTAFR
SCHEMBL9519875 0.88 PTAFR (1.00) PTAFR
SCHEMBL9519883 0.88 PTAFR (1.00) PTAFR
SCHEMBL9519321 0.88 PTAFR (1.00) PTAFR
SCHEMBL9519782 0.88 PTAFR (1.00) PTAFR
SCHEMBL10398821 0.88 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4975438-A ANTICOAGULANT HOFFMANN-LA ROCHE INC. (US) 1990-12-04 US disclosed