SCHEMBL9705594

SCHEMBL9705594

CCOC(=O)c1cc(OC)n(-c2c(Cl)cc(C(F)(F)F)cc2Cl)n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRB3 P28472 10/20 0.59
GABRA2 P47869 7/20 0.59
GABRB2 P47870 7/20 0.59
GABRP O00591 4/20 0.59
GABRD O14764 4/20 0.59
GABRA1 P14867 4/20 0.59
GABRB1 P18505 4/20 0.59
GABRG2 P18507 4/20 0.59
GABRA5 P31644 4/20 0.59
GABRA3 P34903 4/20 0.59
GABRA4 P48169 4/20 0.59
GABRE P78334 4/20 0.59
GABRA6 Q16445 4/20 0.59
GABRG1 Q8N1C3 4/20 0.59
GABRG3 Q99928 4/20 0.59
GABRQ Q9UN88 4/20 0.59
TP53 P04637 3/20 0.43
MAPT P10636 3/20 0.43
KMT2A Q03164 2/20 0.43
TDP1 Q9NUW8 2/20 0.43

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
SCHEMBL7713193 0.85 GABRB3 (0.62) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL2836888 0.81 GABRB3 (0.53) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7707130 0.77 GABRB3 (0.77) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7711694 0.77 GABRB3 (0.77) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7706572 0.77 GABRB3 (0.77) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL9704114 0.77 GABRB3 (0.53) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL16876795 0.77 GABRP (0.48) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL9704304 0.76 GABRB3 (0.76) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL10571736 0.76 GABRB3 (0.76) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL19356997 0.75 PDE4B (0.61) TP53MAPTKMT2ATDP1POLB

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