SCHEMBL9705129

SCHEMBL9705129

N#Cc1cn(-c2c(Cl)cc(C(F)(F)F)cc2Cl)nc1-c1nc(C#N)c(C#N)[nH]1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA2 P47869 5/20 0.39
GABRB2 P47870 5/20 0.39
GABRB3 P28472 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
GABRP O00591 2/20 0.39
GABRD O14764 2/20 0.39
GABRA1 P14867 2/20 0.39
GABRB1 P18505 2/20 0.39
GABRG2 P18507 2/20 0.39
GABRA5 P31644 2/20 0.39
GABRA3 P34903 2/20 0.39
GABRA4 P48169 2/20 0.39
GABRE P78334 2/20 0.39
GABRA6 Q16445 2/20 0.39
GABRG1 Q8N1C3 2/20 0.39
GABRG3 Q99928 2/20 0.39
GABRQ Q9UN88 2/20 0.39
NR1I2 O75469 1/20 0.39
LMNA P02545 1/20 0.39
CYP3A4 P08684 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
SCHEMBL9703438 0.88 GABRA2 (0.38) GABRA2GABRB2GABRB3SMN1; SMN2GABRP
SCHEMBL9705755 0.86 GABRA2 (0.36) GABRA2GABRB2GABRB3SMN1; SMN2GABRP
SCHEMBL9216218 0.81 GABRB3 (0.40) GABRA2GABRB2GABRB3SMN1; SMN2GABRP
SCHEMBL9218702 0.80 GABRA2 (0.46) GABRA2GABRB2GABRB3SMN1; SMN2GABRP
SCHEMBL9219860 0.80 GABRB3 (0.47) GABRA2GABRB2GABRB3SMN1; SMN2GABRP
SCHEMBL9211807 0.80 GABRB3 (0.39) GABRA2GABRB2GABRB3SMN1; SMN2GABRP
SCHEMBL9703893 0.80 GABRA2 (0.41) GABRA2GABRB2GABRB3SMN1; SMN2GABRP
SCHEMBL9210928 0.79 GABRB3 (0.39) GABRA2GABRB2GABRB3SMN1; SMN2GABRP
SCHEMBL9705037 0.78 GABRB3 (0.44) GABRA2GABRB2GABRB3SMN1; SMN2GABRP
SCHEMBL9703909 0.78 GABRB3 (0.38) GABRA2GABRB2GABRB3SMN1; SMN2GABRP

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