SCHEMBL4722499

SCHEMBL4722499

CCNc1cc(-c2cc(C)cc(/C=N/O)c2)nn(-c2cc(-c3cccnn3)ccc2C(F)(F)F)c1=O

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 1/20 0.31
SCN9A Q15858 1/20 0.31

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
SCHEMBL4722501 1.00 SCN5A (0.31) SCN5ASCN9A
SCHEMBL4766566 0.82
SCHEMBL4723920 0.79 P2RX7 (0.34)
SCHEMBL4723917 0.79 P2RX7 (0.34)
SCHEMBL4723056 0.71 LMNA (0.32)
SCHEMBL4720181 0.70 NTRK1 (0.32)
SCHEMBL4724001 0.70 PDE4A (0.36) SCN5ASCN9A
SCHEMBL4719842 0.70 PDE4A (0.38) SCN5ASCN9A
SCHEMBL4721092 0.70 WNT3A (0.30)
SCHEMBL4719853 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1953147-A1 HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF Japan Tobacco, Inc. (JP) 2008-08-06 EP disclosed
EP-1953147-A1 HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF Japan Tobacco, Inc. (JP) 2008-08-06 EP disclosed