SCHEMBL5203592

SCHEMBL5203592

CSc1c(C(C)=O)nn(-c2c(Cl)cc(C(F)(F)F)cc2Cl)c1N

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GABRP O00591 20/20 0.61
GABRD O14764 20/20 0.61
GABRA1 P14867 20/20 0.61
GABRB1 P18505 20/20 0.61
GABRG2 P18507 20/20 0.61
GABRB3 P28472 20/20 0.61
GABRA5 P31644 20/20 0.61
GABRA3 P34903 20/20 0.61
GABRA2 P47869 20/20 0.61
GABRB2 P47870 20/20 0.61
GABRA4 P48169 20/20 0.61
GABRE P78334 20/20 0.61
GABRA6 Q16445 20/20 0.61
GABRG1 Q8N1C3 20/20 0.61
GABRG3 Q99928 20/20 0.61
GABRQ Q9UN88 20/20 0.61

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
SCHEMBL7667394 0.88 GABRP (0.62) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL14012883 0.87 GABRP (0.55) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7242062 0.86 GABRP (0.57) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7019236 0.84 GABRP (0.57) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7242839 0.83 GABRP (0.56) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7019234 0.83 GABRP (0.57) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7667400 0.82 GABRP (0.67) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7711336 0.81 GABRP (0.66) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7713492 0.81 GABRP (0.66) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL6055926 0.80 GABRP (0.69) 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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0948486-B1 PESTICIDAL 1-ARYLPYRAZOLES MERIAL LTD (GB) 2007-11-28 EP claimed
US-6403628-B1 APHIDICIDE WITH REDUCED TOXICITY TO MAMMALS RHONE-POULENC AGRO (FR) 2002-06-11 US claimed
EP-0948486-A1 PESTICIDAL 1-ARYLPYRAZOLES RHONE-POULENC AGROCHIMIE (FR) 1999-10-13 EP claimed
WO-1998028277-A1 PESTICIDAL 1-ARYLPYRAZOLES RHONE-POULENC AGROCHIMIE (FR) 1998-07-02 WO claimed
EP-0948486-B1 PESTICIDAL 1-ARYLPYRAZOLES MERIAL LTD (GB) 2007-11-28 EP disclosed
EP-0973747-B1 PESTICIDAL 1-ARYLPYRAZOLES BAYER CROPSCIENCE SA (FR) 2003-10-15 EP disclosed
US-6403628-B1 APHIDICIDE WITH REDUCED TOXICITY TO MAMMALS RHONE-POULENC AGRO (FR) 2002-06-11 US disclosed
US-6395760-B1 FOR AGRICULTURE RHONE-POULENC INC. 2002-05-28 US disclosed
US-6201003-B1 INSECTICIDES, MITICIDES, APHIDICIDES, ANTHELMINTICS FOR CROPS, VETERINARY MEDICINE, HORTICULTURE AND AGRICULTURE RHONE-POULENC INC. 2001-03-13 US disclosed
US-6087387-A 3-ACETYL-1-PHENYL-PYRAZOLE DERIVATIVES INSECTICIDE USEFUL IN THE CONTROL OF INSECTS, NEMATODES OR HELMINTHS RHONE-POULENC AGRO (FR) 2000-07-11 US disclosed
US-6057354-A USED, PARTICULARLY IN AGRICULTURE AND FOR ANIMAL PROTECTION, AS PESTICIDES, ESPECIALLY FOR CONTROLLING ARTHROPODS RHONE-POULENC INC. (US) 2000-05-02 US disclosed
EP-0973747-A1 PESTICIDAL 1-ARYLPYRAZOLES RHONE-POULENC AGRO (FR) 2000-01-26 EP disclosed
EP-0948486-A1 PESTICIDAL 1-ARYLPYRAZOLES RHONE-POULENC AGROCHIMIE (FR) 1999-10-13 EP disclosed
WO-1998040359-A1 PESTICIDAL 1-ARYLPYRAZOLES RHONE-POULENC AGRO (FR) 1998-09-17 WO disclosed
WO-1998028277-A1 PESTICIDAL 1-ARYLPYRAZOLES RHONE-POULENC AGROCHIMIE (FR) 1998-07-02 WO disclosed