SCHEMBL14966255

SCHEMBL14966255

Nc1nc(C(F)(F)F)c(Br)cc1C=O

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.31
PRKDC P78527 1/20 0.30

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
SCHEMBL22246385 0.78 PRKDC (0.37) ERN1PRKDC
SCHEMBL20657797 0.73 ERN1 (0.39) ERN1PRKDC
SCHEMBL14966182 0.71 TBK1 (0.40)
SCHEMBL25262355 0.70 SOS1 (0.48)
SCHEMBL30500676 0.70 SOS1 (0.48)
SCHEMBL31523283 0.67 HTT (0.33)
SCHEMBL20657830 0.67 KMT2A (0.40)
SCHEMBL27886744 0.66 BACE1 (0.44)
SCHEMBL125558 0.66 PIK3CD (0.35)
SCHEMBL19456707 0.66 ENPP3 (0.36)

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
WO-2013072882-A1 2 -AMINO- 1, 8 -NAPHTHYRIDINE-3 -CARBOXAMIDE DERIVATIVES AS ANTIMICROBIAL AGENTS ACTELION PHARMACEUTICALS LTD (CH) 2013-05-23 WO disclosed