SCHEMBL9704328

SCHEMBL9704328

CCOC(=O)c1nn(-c2c(Cl)cc(C(F)(F)F)cc2Cl)cc1OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA2 P47869 5/20 0.50
GABRB2 P47870 5/20 0.50
GABRP O00591 2/20 0.50
GABRD O14764 2/20 0.50
GABRA1 P14867 2/20 0.50
GABRB1 P18505 2/20 0.50
GABRG2 P18507 2/20 0.50
GABRB3 P28472 2/20 0.50
GABRA5 P31644 2/20 0.50
GABRA3 P34903 2/20 0.50
GABRA4 P48169 2/20 0.50
GABRE P78334 2/20 0.50
GABRA6 Q16445 2/20 0.50
GABRG1 Q8N1C3 2/20 0.50
GABRG3 Q99928 2/20 0.50
GABRQ Q9UN88 2/20 0.50
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
MRGPRX4 Q96LA9 1/20 0.41

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
SCHEMBL9704249 0.86 NPC1 (0.57) GABRA2GABRB2GABRPGABRDGABRA1
SCHEMBL9780170 0.86 GABRA2 (0.46) GABRA2GABRB2GABRPGABRDGABRA1
SCHEMBL7711415 0.83 GABRA2 (0.51) GABRA2GABRB2GABRPGABRDGABRA1
SCHEMBL7713362 0.83 GABRA2 (0.48) GABRA2GABRB2GABRPGABRDGABRA1
SCHEMBL7713312 0.83 GABRA2 (0.48) GABRA2GABRB2GABRPGABRDGABRA1
SCHEMBL9704083 0.82 GABRA2 (0.50) GABRA2GABRB2GABRPGABRDGABRA1
SCHEMBL9780180 0.81 GABRA2 (0.53) GABRA2GABRB2GABRPGABRDGABRA1
SCHEMBL9704010 0.80 GABRA2 (0.52) GABRA2GABRB2GABRPGABRDGABRA1
SCHEMBL9704388 0.77 GABRB3 (0.47) GABRA2GABRB2GABRB3
SCHEMBL9217228 0.77 GABRB3 (0.53) GABRA2GABRB2GABRPGABRDGABRA1

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