SCHEMBL15037549

SCHEMBL15037549

Nc1nc2cc(F)ccc2c(=O)n1NC(=O)Cc1cccc(F)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.41
ALDH1A1 P00352 4/20 0.41
HTT P42858 2/20 0.41
PRKACA P17612 1/20 0.41
ROCK1 Q13464 1/20 0.41
GLS O94925 2/20 0.40
KCNQ2 O43526 1/20 0.40
MAPT P10636 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
RAB9A P51151 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
CASR P41180 1/20 0.39
CASP3 P42574 1/20 0.39
CASP7 P55210 1/20 0.39
MAPK8 P45983 1/20 0.39
LMNA P02545 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
ROCK2 O75116 1/20 0.39

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
SCHEMBL13102444 0.87 ALDH1A1 (0.53) NPSR1ALDH1A1HTTMAPTL3MBTL1
SCHEMBL3378112 0.87 ALDH1A1 (0.43) NPSR1ALDH1A1HTTPRKACAROCK1
SCHEMBL13102109 0.85 LMNA (0.43) NPSR1ALDH1A1HTTPRKACAROCK1
SCHEMBL13102264 0.84 ALDH1A1 (0.46) NPSR1ALDH1A1HTTGLSMAPT
SCHEMBL13102069 0.83 NPSR1 (0.41) NPSR1ALDH1A1HTTPRKACAROCK1
SCHEMBL13102314 0.83 SMN1; SMN2 (0.49) ALDH1A1MAPTSIGMAR1LMNAMEN1
SCHEMBL13101709 0.83 MEN1 (0.44) NPSR1ALDH1A1HTTMAPTL3MBTL1
SCHEMBL13102241 0.83 ALDH1A1 (0.44) NPSR1ALDH1A1HTTMAPTL3MBTL1
SCHEMBL3381133 0.82 RAB9A (0.48) NPSR1ALDH1A1HTTPRKACAROCK1
SCHEMBL13101669 0.82 SIGMAR1 (0.42) NPSR1ALDH1A1HTTPRKACAROCK1

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
EP-1663237-B1 FUSED RING HETEROCYCLES AS POTASSIUM CHANNEL MODULATORS ICAGEN INC (US) 2013-06-19 EP disclosed