SCHEMBL8842686

SCHEMBL8842686

CCOOCC(C)N1C(=O)c2cc(CCCCOc3cccnc3NC(=O)OC(C)(C)C)ccc2N(c2ccccc2)C(=O)C1c1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PPIA P62937 1/20 0.32

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
SCHEMBL8842893 0.93
SCHEMBL8842811 0.93 SCN9A (0.33) PPIA
SCHEMBL8843420 0.93 PPIA (0.33) PPIA
SCHEMBL8842961 0.91 MDM2 (0.33) PPIA
SCHEMBL7332332 0.91 PPIA (0.32) PPIA
SCHEMBL7335488 0.86
SCHEMBL8843209 0.86 PPIA (0.32) PPIA
SCHEMBL8843425 0.85 SCN9A (0.33) PPIA
SCHEMBL8843216 0.84 MDM2 (0.34)
SCHEMBL7330387 0.83 SCN9A (0.33) PPIA

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-5663166-A ANTICOAGULANTS OF 1,4-BENZODIAZEPINE-2,5-DIONE AND 2-BENZOAZEPINE-1,4-DIONE DERIVATIVES; PREVENTS FIBRINOGEN BINDING NECESSARY FOR PLATELET AGGREGATION; SIDE EFFECT REDUCTION, E.G. EXCESSIVE BLEEDING GENENTECH, INC. (US) 1997-09-02 US disclosed