SCHEMBL9368255

SCHEMBL9368255

CC(C)(C)c1cn(-c2c(Cl)cc(C(F)(F)F)cc2Cl)cn1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GABRA2 P47869 13/20 0.61
GABRB2 P47870 13/20 0.61
GABRB3 P28472 11/20 0.42
GABRP O00591 3/20 0.41
GABRD O14764 3/20 0.41
GABRA1 P14867 3/20 0.41
GABRB1 P18505 3/20 0.41
GABRG2 P18507 3/20 0.41
GABRA5 P31644 3/20 0.41
GABRA3 P34903 3/20 0.41
GABRA4 P48169 3/20 0.41
GABRE P78334 3/20 0.41
GABRA6 Q16445 3/20 0.41
GABRG1 Q8N1C3 3/20 0.41
GABRG3 Q99928 3/20 0.41
GABRQ Q9UN88 3/20 0.41
BACE1 P56817 1/20 0.40

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
SCHEMBL9368041 0.92 GABRA2 (0.56) GABRA2GABRB2GABRB3GABRPGABRD
SCHEMBL9369203 0.85 GABRA2 (0.47) GABRA2GABRB2GABRB3GABRPGABRD
SCHEMBL9366271 0.84 GABRA2 (0.46) GABRA2GABRB2GABRB3GABRPGABRD
SCHEMBL9366343 0.84 GABRA2 (0.46) GABRA2GABRB2GABRB3GABRPGABRD
SCHEMBL9366657 0.82 GABRA2 (0.45) GABRA2GABRB2GABRB3GABRPGABRD
SCHEMBL9365121 0.77 GABRA2 (0.43) GABRA2GABRB2GABRB3GABRPGABRD
SCHEMBL9365637 0.76 GABRA2 (0.42) GABRA2GABRB2GABRB3GABRPGABRD
SCHEMBL9365659 0.76 GABRA2 (0.42) GABRA2GABRB2GABRB3GABRPGABRD
SCHEMBL9365401 0.75 GABRA2 (0.41) GABRA2GABRB2GABRB3GABRPGABRD
SCHEMBL9119890 0.75 GABRA2 (0.44) GABRA2GABRB2GABRB3GABRPGABRD

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0445931-B1 A 4-tert.-butyl imidazole derivative and its production and use SUMITOMO CHEMICAL CO (JP) 1994-08-03 EP claimed
US-5180732-A Insecticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-01-19 US claimed
EP-0445931-A1 A 4-tert.-butyl imidazole derivative and its production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-09-11 EP claimed