SCHEMBL6976085

SCHEMBL6976085

N#Cc1cc(N)n(-c2c(Cl)cc(Cl)cc2Cl)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.51
GABRP O00591 5/20 0.39
GABRD O14764 5/20 0.39
GABRA1 P14867 5/20 0.39
GABRB1 P18505 5/20 0.39
GABRG2 P18507 5/20 0.39
GABRB3 P28472 5/20 0.39
GABRA5 P31644 5/20 0.39
GABRA3 P34903 5/20 0.39
GABRA2 P47869 5/20 0.39
GABRB2 P47870 5/20 0.39
GABRA4 P48169 5/20 0.39
GABRE P78334 5/20 0.39
GABRA6 Q16445 5/20 0.39
GABRG1 Q8N1C3 5/20 0.39
GABRG3 Q99928 5/20 0.39
GABRQ Q9UN88 5/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
KMT2A Q03164 3/20 0.38

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
SCHEMBL7480496 0.87 GABRP (0.40) KDRGABRPGABRDGABRA1GABRB1
SCHEMBL7239468 0.87 KDR (0.39) KDRGABRPGABRDGABRA1GABRB1
SCHEMBL7489890 0.85 KDR (0.40) KDRGABRPGABRDGABRA1GABRB1
SCHEMBL30831882 0.84 GABRA2 (0.45) KDRGABRPGABRDGABRA1GABRB1
SCHEMBL239495 0.83 GABRB3 (0.60) GABRPGABRDGABRA1GABRB1GABRG2
Ammonia Solution, Strong SCHEMBL8425567 0.82 GABRB3 (0.59) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL10768639 0.81 LMNA (0.42) KDRL3MBTL1KMT2AMEN1LMNA
SCHEMBL2002008 0.79 GABRP (0.36) KDRGABRPGABRDGABRA1GABRB1
SCHEMBL2138287 0.79 GABRP (0.44) KDRGABRPGABRDGABRA1GABRB1
SCHEMBL2003583 0.79 MAPT (0.44) KDRGABRPGABRDGABRA1GABRB1

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003064384-A2 ENVIRONMENT FRIENDLY REAGENTS AND PROCESS FOR TRIFLUOROMETHYLSULFINYLATION OF ORGANIC COMPOUNDS VIRBAC S.A. (FR) 2003-08-07 WO claimed
EP-1331222-A1 Environment friendly reagents and process for halogenoalkylsulfinylation of organic compounds VIRBAC S.A. (FR) 2003-07-30 EP claimed
EP-0933363-B1 Parasiticidal pyrazoles PFIZER LTD (GB) 2003-08-27 EP disclosed
WO-2003064384-A2 ENVIRONMENT FRIENDLY REAGENTS AND PROCESS FOR TRIFLUOROMETHYLSULFINYLATION OF ORGANIC COMPOUNDS VIRBAC S.A. (FR) 2003-08-07 WO disclosed
EP-1331222-A1 Environment friendly reagents and process for halogenoalkylsulfinylation of organic compounds VIRBAC S.A. (FR) 2003-07-30 EP disclosed
EP-0946515-B1 PARASITICIDAL PYRAZOLES PFIZER LTD (GB) 2003-03-05 EP disclosed
US-20020173662-A1 Parasiticidal pyrazoles BANKS BERNARD JOSEPH (GB) 2002-11-21 US 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-20020016468-A1 PESTICIDAL 1-ARYLPYRAZOLE DERIVATIVES RHONE-POULENC AGROCHIMIE (FR) 2002-02-07 US disclosed
US-6268509-B1 PESTICIDES PFIZER INC 2001-07-31 US disclosed
US-6090394-A FOR HUMANS, ANIMALS PFIZER INC. (US) 2000-07-18 US disclosed
US-5547974-A INSECTICIDES, NEMATOCIDES, ANTHELMINTICS RHONE-POULENC AGRICULTURE LTD. (GB) 1996-08-20 US disclosed
CN-1032201-C Process for preparing perhaloalkylthioethers RHONE POULENC AGROCHIMIE (FR) 1996-07-03 CN disclosed
EP-0418016-B1 N-phenylpyrazole derivatives as insecticides RHONE POULENC AGRICULTURE (GB) 1995-05-03 EP disclosed
EP-0374061-B1 Process for the preparation of perhalogen alkyl thio ethers RHONE POULENC AGROCHIMIE (FR) 1994-06-15 EP disclosed
US-5283337-A Reacting reducing agent, disulfide, perhaloalkyl halide RHONE-POULENC AGROCHIMIE (FR) 1994-02-01 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
US-5082945-A Reducing agent, perfluoroalkyl halide, disulfide RHONE-POULENC AGROCHIMIE (FR) 1992-01-21 US disclosed
EP-0418016-A1 N-phenylpyrazole derivatives as insecticides RHONE-POULENC AGRICULTURE LTD. (GB) 1991-03-20 EP disclosed
EP-0295117-A1 Derivatives of N-phenylpyrazoles RHONE-POULENC AGRICULTURE LIMITED (GB) 1988-12-14 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020173662-A1 Parasiticidal pyrazoles HRH3, HRH2, HRH1 KDR 4023/4885GABRP 799/4885GABRD 1289/4885
US-20020016468-A1 PESTICIDAL 1-ARYLPYRAZOLE DERIVATIVES DDT, NAT1, CYP2E1 KDR 3902/4885GABRP 1003/4885GABRD 1930/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.