SCHEMBL7715369

SCHEMBL7715369

CCOC(=O)c1nn(-c2c(Cl)cc(C(F)(F)F)cc2Cl)c(N)c1[S+]([O-])C(F)(F)F

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GABRP O00591 19/20 0.62
GABRD O14764 19/20 0.62
GABRA1 P14867 19/20 0.62
GABRB1 P18505 19/20 0.62
GABRG2 P18507 19/20 0.62
GABRB3 P28472 19/20 0.62
GABRA5 P31644 19/20 0.62
GABRA3 P34903 19/20 0.62
GABRA2 P47869 19/20 0.62
GABRB2 P47870 19/20 0.62
GABRA4 P48169 19/20 0.62
GABRE P78334 19/20 0.62
GABRA6 Q16445 19/20 0.62
GABRG1 Q8N1C3 19/20 0.62
GABRG3 Q99928 19/20 0.62
GABRQ Q9UN88 19/20 0.62
ADORA1 P30542 1/20 0.42

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
SCHEMBL20089290 0.86 GABRP (0.53) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL15329426 0.85 GABRB3 (0.48) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7779071 0.84 GABRP (0.51) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL18393472 0.84 GABRA2 (0.56) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7711355 0.82 GABRP (0.64) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7815001 0.82 GABRB3 (0.62) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL4751430 0.81 GABRP (0.53) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL33214 0.81 GABRP (0.52) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7023353 0.81 GABRP (0.50) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7247054 0.81 GABRP (0.48) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6372774-B1 THESE COMPOUNDS POSSESS ARTHROPODICIDAL, PLANT NEMATOCIDAL, ANTHELMINTIC AND ANTI-PROTOZOAL PROPERTIES RHONE-POULENC AGRICULTURE LTD. (GB) 2002-04-16 US disclosed
EP-0967206-A1 Derivatives of N-phenylpyrazoles RHONE POULENC AGRICULTURE LTD. (GB) 1999-12-29 EP disclosed
US-5916618-A PESTICIDE FOR MEDICATED FEEDSTUFF, DIETARY CONCENTRATE OR SUPPLEMENT RHONE-POULENC AGRICULTURE LTD. (GB) 1999-06-29 US disclosed
US-5714191-A PESTICIDES USED IN MEDICATED FEEDSTUFF, MINERAL SALT LICK OR EDIBLE BAIT RHONE-POULENC AGRICULTURE LTD. (GB) 1998-02-03 US disclosed
US-5608077-A INSECTICIDES, NEMATOCIDES, ANTHELMINTICS, ANTIPROTOZOA AGENTS RHONE-POULENC AGRICULTURE LTD. (GB) 1997-03-04 US disclosed
US-5547974-A INSECTICIDES, NEMATOCIDES, ANTHELMINTICS RHONE-POULENC AGRICULTURE LTD. (GB) 1996-08-20 US disclosed
US-5232940-A Controlling insects, plant nematodes, helminths, protozoa BASF AGRO B.V., ARNHEM (NL), WADENSWIL-BRANCH (CH) 1993-08-03 US disclosed
EP-0295117-A1 Derivatives of N-phenylpyrazoles RHONE-POULENC AGRICULTURE LIMITED (GB) 1988-12-14 EP disclosed