SCHEMBL14063

SCHEMBL14063

NCCCC(N)c1ccc(-n2ccc(N)nc2=O)cc1

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 4/20 0.35
FGFR1 P11362 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
SCHEMBL14850158 0.80
SCHEMBL14137 0.73 MC4R (0.42) ROCK2
SCHEMBL22995728 0.70 XDH (0.42) ROCK2
SCHEMBL21508041 0.70 ALDH1A1 (0.35) ROCK2FGFR1
SCHEMBL25576468 0.70 ROCK2 (0.38) ROCK2FGFR1
SCHEMBL22254521 0.70 ROCK2 (0.47) ROCK2
SCHEMBL22254231 0.69 ROCK2 (0.34) ROCK2
SCHEMBL22254520 0.69 ROCK2 (0.48) ROCK2FGFR1
SCHEMBL25532098 0.69 ROCK2 (0.51) ROCK2
SCHEMBL13811 0.69 FGFR1 (0.39) FGFR1

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-2011047323-A2 ANTIMICROBIAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME RIB-X PHARMACEUTICALS, INC. (US) 2011-04-21 WO disclosed