SCHEMBL7970041

SCHEMBL7970041

CS(=O)(=O)c1n[nH]c(-c2c(Cl)cc(C(F)(F)F)cc2Cl)c1C#N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLP1R P43220 2/20 0.39
GABRP O00591 4/20 0.37
GABRD O14764 4/20 0.37
GABRA1 P14867 4/20 0.37
GABRB1 P18505 4/20 0.37
GABRG2 P18507 4/20 0.37
GABRB3 P28472 4/20 0.37
GABRA5 P31644 4/20 0.37
GABRA3 P34903 4/20 0.37
GABRA2 P47869 4/20 0.37
GABRB2 P47870 4/20 0.37
GABRA4 P48169 4/20 0.37
GABRE P78334 4/20 0.37
GABRA6 Q16445 4/20 0.37
GABRG1 Q8N1C3 4/20 0.37
GABRG3 Q99928 4/20 0.37
GABRQ Q9UN88 4/20 0.37
ATM Q13315 1/20 0.36
DHODH Q02127 1/20 0.35
SHMT1 P34896 1/20 0.33

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
SCHEMBL7969879 0.82 GLP1R (0.33) GLP1RATMALDH1A1KDM4EHPGD
SCHEMBL7966297 0.78 GABRP (0.51) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7970003 0.76 GABRP (0.37) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7970166 0.74 GLP1R (0.42) GLP1RGABRPGABRDGABRA1GABRB1
SCHEMBL8554505 0.73 GABRP (0.36) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL18424213 0.73 GLP1R (0.36) GLP1RGABRPGABRDGABRA1GABRB1
SCHEMBL6597045 0.73 GABRP (0.35) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL8401036 0.72 GABRP (0.37) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL8550923 0.72 GABRP (0.34) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL8551079 0.72 GABRP (0.34) GABRPGABRDGABRA1GABRB1GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001007413-A1 1-ARYL-3-THIOALKYL PYRAZOLES, THE SYNTHESIS THEREOF AND THE USE THEREOF AS INSECTICIDES 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2001-02-01 WO claimed
WO-2001007413-A1 1-ARYL-3-THIOALKYL PYRAZOLES, THE SYNTHESIS THEREOF AND THE USE THEREOF AS INSECTICIDES 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2001-02-01 WO disclosed