SCHEMBL9705715

SCHEMBL9705715

CCOC(=O)c1cnn(-c2c(Cl)cc(C(F)(F)F)cc2Cl)c1SC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRB3 P28472 11/20 0.59
GABRA2 P47869 9/20 0.59
GABRB2 P47870 9/20 0.59
GABRP O00591 6/20 0.59
GABRD O14764 6/20 0.59
GABRA1 P14867 6/20 0.59
GABRB1 P18505 6/20 0.59
GABRG2 P18507 6/20 0.59
GABRA5 P31644 6/20 0.59
GABRA3 P34903 6/20 0.59
GABRA4 P48169 6/20 0.59
GABRE P78334 6/20 0.59
GABRA6 Q16445 6/20 0.59
GABRG1 Q8N1C3 6/20 0.59
GABRG3 Q99928 6/20 0.59
GABRQ Q9UN88 6/20 0.59
MAPT P10636 2/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL9310988 0.86 GABRB3 (0.55) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL10560642 0.85 GABRB3 (0.54) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL9209147 0.84 GABRB3 (0.53) GABRB3GABRA2GABRB2GABRPGABRD
Ammonia Solution, Strong SCHEMBL10557787 0.84 GABRB3 (0.53) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL9211791 0.84 NPC1 (0.63) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL9704966 0.81 SMN1; SMN2 (0.58) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL10400843 0.79 NPC1 (0.59) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL10394640 0.78 HTT (0.54) MAPTRAB9ASMN1; SMN2HTTMEN1
SCHEMBL9704455 0.76 GABRB3 (0.48) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL10769999 0.75 GABRB3 (0.51) GABRB3GABRA2GABRB2GABRPGABRD

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