SCHEMBL256606

SCHEMBL256606

C=C(N)c1cc(F)cnc1Cl

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
SCHEMBL256609 0.82 SCN5A (0.34) SCN5ASCN9A
SCHEMBL168694 0.81 CASP1 (0.42) SCN5ASCN9A
SCHEMBL290570 0.74 KEAP1 (0.53) SCN5ASCN9A
SCHEMBL27598069 0.74 KEAP1 (0.53) SCN5ASCN9A
SCHEMBL31349524 0.74 KEAP1 (0.53) SCN5ASCN9A
SCHEMBL8357219 0.74 SCN5A (0.36) SCN5ASCN9A
SCHEMBL4966985 0.74 ALDH1A1 (0.36) SCN5ASCN9A
SCHEMBL19250759 0.74 ALDH1A1 (0.37)
SCHEMBL9928617 0.73 AGBL2 (0.39) SCN5ASCN9A
SCHEMBL20010499 0.73 OPRK1 (0.35) SCN5ASCN9A

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
WO-2017133667-A1 PYRIMIDINE AND PYRIDINE DERIVATIVES AND USE IN TREATMENT, AMELIORATION OR PREVENTION OF INFLUENZA THEREOF SAVIRA PHARMACEUTICALS GMBH (AT) 2017-08-10 WO disclosed
WO-2012028645-A1 METHOD FOR THE PRODUCTION OF 5-FLUORO-1H-PYRAZOLO[3,4-B]PYRIDINE-3-CARBONITRILE BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-03-08 WO disclosed