SCHEMBL6168749

SCHEMBL6168749

Cc1cc(N)n(-c2c(Cl)cc(C(F)(F)F)cc2Cl)n1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GABRB3 P28472 19/20 0.68
GABRA2 P47869 17/20 0.68
GABRB2 P47870 17/20 0.68
GABRP O00591 15/20 0.68
GABRD O14764 15/20 0.68
GABRA1 P14867 15/20 0.68
GABRB1 P18505 15/20 0.68
GABRG2 P18507 15/20 0.68
GABRA5 P31644 15/20 0.68
GABRA3 P34903 15/20 0.68
GABRA4 P48169 15/20 0.68
GABRE P78334 15/20 0.68
GABRA6 Q16445 15/20 0.68
GABRG1 Q8N1C3 15/20 0.68
GABRG3 Q99928 15/20 0.68
GABRQ Q9UN88 15/20 0.68

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
SCHEMBL7711657 0.84 GABRB3 (0.67) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL6976717 0.84 GABRB3 (0.51) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7713221 0.83 GABRB3 (0.65) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL6962955 0.83 GABRB3 (0.65) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7707146 0.83 GABRB3 (0.65) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL10562514 0.82 GABRA2 (0.64) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL5826687 0.82 KDR (0.54) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL6054602 0.81 GABRB3 (0.63) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7814766 0.80 GAA (0.52) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL239495 0.79 GABRB3 (0.60) 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 38 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-7070077-A None JP disclosed
EP-0659745-B1 Substituted 1-aryl pyrazoles BAYER CROPSCIENCE AG (DE) 2005-07-27 EP disclosed
CN-1106386-C Parasiticidal pyrazoles PFIZER LTD (US) 2003-04-23 CN disclosed
EP-0946515-B1 PARASITICIDAL PYRAZOLES PFIZER LTD (GB) 2003-03-05 EP disclosed
US-6372774-B1 THESE COMPOUNDS POSSESS ARTHROPODICIDAL, PLANT NEMATOCIDAL, ANTHELMINTIC AND ANTI-PROTOZOAL PROPERTIES RHONE-POULENC AGRICULTURE LTD. (GB) 2002-04-16 US disclosed
US-RE37495-E1 Substituted 1-arylpyrazoles BAYER AKTIENGESELLSCHAFT (DE) 2002-01-01 US disclosed
EP-0871617-B1 PARASITICIDAL COMPOUNDS PFIZER (US) 2001-11-14 EP disclosed
US-6268509-B1 PESTICIDES PFIZER INC 2001-07-31 US disclosed
US-6255333-B1 HUMANS OR ANIMALS PFIZER INC. 2001-07-03 US disclosed
CN-1061037-C Substituted 1-arylpyrazoles BAYER AG (DE) 2001-01-24 CN disclosed
US-4908377-A Pesticides BAYER AKTIENGESELLSCHAFT (DE) 1990-03-13 US disclosed
US-4810720-A INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1989-03-07 US disclosed
US-4804675-A 1-aryl-4-alkylthiopyrazol-5-amine derivatives, composition containing them, and method of using them to combat insects, arachnids, and nematodes BAYER AKTIENGESELLSCHAFT (DE) 1989-02-14 US disclosed
EP-0295482-A1 Substituted 5-ethylamino-1-arylpyrazoles BAYER AG (DE) 1988-12-21 EP disclosed
EP-0249033-A1 5-Oxy(thio)-pyrazole derivatives BAYER AG (DE) 1987-12-16 EP disclosed
EP-0234119-A1 Pesticidal method using N-phenylpyrazoles RHONE-POULENC AGROCHIMIE (FR) 1987-09-02 EP disclosed
EP-0231510-A2 1-Aryl pyrazoles BAYER AG (DE) 1987-08-12 EP disclosed
CN-86108643-A Insecticidal method using N-phenylpyrazoles 1987-07-29 CN disclosed
WO-1987003781-A1 PESTICIDAL METHOD USING N-PHENYLPYRAZOLES MAY & BAKER LIMITED (GB) 1987-07-02 WO disclosed
EP-0201852-A2 Agent against noxious plants based on pyrazol derivatives BAYER AG (DE) 1986-11-20 EP disclosed