SCHEMBL8026716

SCHEMBL8026716

Cc1c(SC(F)(Cl)Cl)c(C#N)c(Cl)n1-c1c(Cl)cc(C(F)(F)F)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRB3 P28472 17/20 0.44
GABRA2 P47869 16/20 0.44
GABRB2 P47870 16/20 0.44
GABRP O00591 11/20 0.44
GABRD O14764 11/20 0.44
GABRA1 P14867 11/20 0.44
GABRB1 P18505 11/20 0.44
GABRG2 P18507 11/20 0.44
GABRA5 P31644 11/20 0.44
GABRA3 P34903 11/20 0.44
GABRA4 P48169 11/20 0.44
GABRE P78334 11/20 0.44
GABRA6 Q16445 11/20 0.44
GABRG1 Q8N1C3 11/20 0.44
GABRG3 Q99928 11/20 0.44
GABRQ Q9UN88 11/20 0.44
NR1I2 O75469 1/20 0.33
LMNA P02545 1/20 0.33
CYP3A4 P08684 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL8541014 0.93 GABRB3 (0.41) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL8446582 0.91 GABRB3 (0.45) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7812035 0.88 TDP1 (0.39) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL8822792 0.86 GABRB3 (0.47) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL8822741 0.85 GABRA2 (0.49) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7825839 0.83 TDP1 (0.41) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL9028128 0.83 GABRP (0.40) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL9028676 0.83 GABRP (0.40) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL9026541 0.80 GABRB3 (0.48) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL9028426 0.77 GABRB3 (0.48) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0738713-B1 Process for the preparation of pesticidal 1-(chloroaryl)heterocyclic compounds RHONE POULENC AGROCHIMIE (FR) 2000-02-09 EP disclosed
US-5726324-A 1-(nitroaryl)pyrrole intermediates to pesticidal 1-(haloaryl)pyrroles RHONE-POULENC INC. (US) 1998-03-10 US disclosed
US-5631381-A Process for the preparation of pesticidal 1-(haloaryl) heterocyclic compounds RHONE-POULENC INC. (US) 1997-05-20 US disclosed
EP-0738713-A1 Process for the preparation of pesticidal 1-(haloaryl)heterocyclic compounds RHONE-POULENC AGROCHIMIE (FR) 1996-10-23 EP disclosed