SCHEMBL8822741

SCHEMBL8822741

N#Cc1c(SC(F)(Cl)Cl)c(N)n(-c2c(Cl)cc(C(F)(F)F)cc2Cl)c1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA2 P47869 20/20 0.49
GABRB2 P47870 20/20 0.49
GABRP O00591 19/20 0.49
GABRD O14764 19/20 0.49
GABRA1 P14867 19/20 0.49
GABRB1 P18505 19/20 0.49
GABRG2 P18507 19/20 0.49
GABRB3 P28472 19/20 0.49
GABRA5 P31644 19/20 0.49
GABRA3 P34903 19/20 0.49
GABRA4 P48169 19/20 0.49
GABRE P78334 19/20 0.49
GABRA6 Q16445 19/20 0.49
GABRG1 Q8N1C3 19/20 0.49
GABRG3 Q99928 19/20 0.49
GABRQ Q9UN88 19/20 0.49
NR1I2 O75469 1/20 0.40
LMNA P02545 1/20 0.40
CYP3A4 P08684 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL8442972 0.91 GABRA2 (0.50) GABRA2GABRB2GABRPGABRDGABRA1
SCHEMBL8026716 0.85 GABRB3 (0.44) GABRA2GABRB2GABRPGABRDGABRA1
SCHEMBL8445533 0.83 GABRP (0.48) GABRA2GABRB2GABRPGABRDGABRA1
SCHEMBL9027804 0.83 GABRA2 (0.47) GABRA2GABRB2GABRPGABRDGABRA1
SCHEMBL8822792 0.83 GABRB3 (0.47) GABRA2GABRB2GABRPGABRDGABRA1
SCHEMBL9028128 0.81 GABRP (0.40) GABRA2GABRB2GABRPGABRDGABRA1
SCHEMBL9028676 0.81 GABRP (0.40) GABRA2GABRB2GABRPGABRDGABRA1
SCHEMBL3539387 0.81 GABRA2 (0.49) GABRA2GABRB2GABRPGABRDGABRA1
SCHEMBL8822759 0.81 GABRA2 (0.49) GABRA2GABRB2GABRPGABRDGABRA1
SCHEMBL8822775 0.80 GABRA2 (0.48) GABRA2GABRB2GABRPGABRDGABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0372982-B1 Pyrrole insecticides RHONE POULENC AGROCHIMIE (FR) 1997-07-02 EP claimed
EP-0372982-A2 Pyrrole insecticides RHONE-POULENC AGROCHIMIE (FR) 1990-06-13 EP claimed
EP-0372982-B1 Pyrrole insecticides RHONE POULENC AGROCHIMIE (FR) 1997-07-02 EP disclosed
US-5506260-A INSECTICIDES, ACARICIDES, NEMATOCIDES RHONE-POULENC AG COMPANY (US) 1996-04-09 US disclosed
US-5187185-A Pesticidal 1-arylpyrroles RHONE-POULENC AG COMPANY (US) 1993-02-16 US disclosed
EP-0372982-A2 Pyrrole insecticides RHONE-POULENC AGROCHIMIE (FR) 1990-06-13 EP disclosed