SCHEMBL6928811

SCHEMBL6928811

CCNc1c(SCC)c(C(N)=S)nn1-c1c(Cl)cc(C(F)(F)F)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GABRB3 P28472 19/20 0.43
GABRA2 P47869 12/20 0.43
GABRB2 P47870 12/20 0.43
GABRP O00591 7/20 0.43
GABRD O14764 7/20 0.43
GABRA1 P14867 7/20 0.43
GABRB1 P18505 7/20 0.43
GABRG2 P18507 7/20 0.43
GABRA5 P31644 7/20 0.43
GABRA3 P34903 7/20 0.43
GABRA4 P48169 7/20 0.43
GABRE P78334 7/20 0.43
GABRA6 Q16445 7/20 0.43
GABRG1 Q8N1C3 7/20 0.43
GABRG3 Q99928 7/20 0.43
GABRQ Q9UN88 7/20 0.43
ALDH1A1 P00352 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
SCHEMBL6927457 0.84 GABRP (0.55) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL10333583 0.76 GABRB3 (0.48) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7069038 0.76 GABRB3 (0.43) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7027170 0.74 GABRP (0.51) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7667394 0.74 GABRP (0.62) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7027165 0.74 GABRP (0.50) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7248733 0.73 GABRB3 (0.40) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7027131 0.73 GABRB3 (0.37) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7707155 0.72 GABRP (0.60) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL8660906 0.72 GABRB3 (0.39) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6518296-B1 For controlling at least one pest selected from the group consisting of insects, arachnids and nematodes BAYER AKTIENGESELLSCHAFT (DE) 2003-02-11 US disclosed
EP-1084111-A1 SUBSTITUTED 3-THIOCARBAMOYLPYRAZOLES Bayer Aktiengesellschaft (DE) 2001-03-21 EP disclosed
WO-1999062886-A1 SUBSTITUTED 3-THIOCARBAMOYLPYRAZOLES BAYER AKTIENGESELLSCHAFT (DE) 1999-12-09 WO disclosed