SCHEMBL8631063

SCHEMBL8631063

CNS(=O)(=O)CCNc1c(S(=O)(=O)NC)c(C(=N)NO)nn1-c1c(Cl)cc(C(F)(F)F)cc1Cl

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GABRB3 P28472 18/20 0.33
GABRA2 P47869 14/20 0.33
GABRB2 P47870 14/20 0.33
GABRP O00591 11/20 0.33
GABRD O14764 11/20 0.33
GABRA1 P14867 11/20 0.33
GABRB1 P18505 11/20 0.33
GABRG2 P18507 11/20 0.33
GABRA5 P31644 11/20 0.33
GABRA3 P34903 11/20 0.33
GABRA4 P48169 11/20 0.33
GABRE P78334 11/20 0.33
GABRA6 Q16445 11/20 0.33
GABRG1 Q8N1C3 11/20 0.33
GABRG3 Q99928 11/20 0.33
GABRQ Q9UN88 11/20 0.33
BACE1 P56817 1/20 0.31
IDO1 P14902 1/20 0.31

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
SCHEMBL8660906 0.77 GABRB3 (0.39) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL8584374 0.77 GABRB3 (0.37) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7027163 0.76 GABRB3 (0.32) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL8531723 0.74 GABRB3 (0.40) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7027745 0.74 GABRP (0.47) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL8582662 0.73 TRPM8 (0.38) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7029612 0.73 GABRP (0.47) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7022565 0.73 KMT2A (0.35) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7250313 0.72 GABRP (0.41) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7249118 0.71 GABRP (0.44) 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-1999017613-A1 METHODE OF INSECT CONTROL RHONE-POULENC AGRO (FR) 1999-04-15 WO disclosed