SCHEMBL9703357

SCHEMBL9703357

N#CC(N)=C(C#N)N=Cc1ncn(-c2c(Cl)cc(C(F)(F)F)cc2Cl)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.40
MAPT P10636 2/20 0.40
GABRA2 P47869 7/20 0.36
GABRB2 P47870 7/20 0.36
GABRB3 P28472 6/20 0.36
GABRP O00591 5/20 0.36
GABRD O14764 5/20 0.36
GABRA1 P14867 5/20 0.36
GABRB1 P18505 5/20 0.36
GABRG2 P18507 5/20 0.36
GABRA5 P31644 5/20 0.36
GABRA3 P34903 5/20 0.36
GABRA4 P48169 5/20 0.36
GABRE P78334 5/20 0.36
GABRA6 Q16445 5/20 0.36
GABRG1 Q8N1C3 5/20 0.36
GABRG3 Q99928 5/20 0.36
GABRQ Q9UN88 5/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NR1I2 O75469 1/20 0.36

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
SCHEMBL9703353 1.00 GAA (0.40) GAAMAPTGABRA2GABRB2GABRB3
SCHEMBL9705767 0.82 GABRA2 (0.41) GAAMAPTGABRA2GABRB2GABRB3
SCHEMBL9703988 0.80 GABRA2 (0.39) GAAMAPTGABRA2GABRB2GABRB3
SCHEMBL9501917 0.80 GABRA2 (0.46) GAAMAPTGABRA2GABRB2GABRB3
SCHEMBL9218195 0.80 GABRA2 (0.46) GAAMAPTGABRA2GABRB2GABRB3
SCHEMBL9501567 0.79 GABRB3 (0.46) GAAMAPTGABRA2GABRB2GABRB3
SCHEMBL9219979 0.79 GABRB3 (0.46) GAAMAPTGABRA2GABRB2GABRB3
SCHEMBL9704990 0.79 GABRA2 (0.40) GAAMAPTGABRA2GABRB2GABRB3
SCHEMBL9704995 0.79 GABRA2 (0.40) GAAMAPTGABRA2GABRB2GABRB3
SCHEMBL9703551 0.78 GAA (0.37) GAAMAPTGABRA2GABRB2GABRB3

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-1992013451-A1 IMIDAZOLE PESTICIDES SCHERING AGROCHEMICALS LIMITED (GB) 1992-08-20 WO disclosed