SCHEMBL7025824

SCHEMBL7025824

CNc1c([S+](C)[O-])c(C(N)=NO)nn1-c1c(Cl)cc(C(F)(F)F)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GABRB3 P28472 19/20 0.38
GABRA2 P47869 18/20 0.38
GABRB2 P47870 18/20 0.38
GABRP O00591 16/20 0.38
GABRD O14764 16/20 0.38
GABRA1 P14867 16/20 0.38
GABRB1 P18505 16/20 0.38
GABRG2 P18507 16/20 0.38
GABRA5 P31644 16/20 0.38
GABRA3 P34903 16/20 0.38
GABRA4 P48169 16/20 0.38
GABRE P78334 16/20 0.38
GABRA6 Q16445 16/20 0.38
GABRG1 Q8N1C3 16/20 0.38
GABRG3 Q99928 16/20 0.38
GABRQ Q9UN88 16/20 0.38
BACE1 P56817 1/20 0.33

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
SCHEMBL7027131 0.89 GABRB3 (0.37) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7028449 0.87 GABRB3 (0.37) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7026658 0.87 GABRB3 (0.34) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7031335 0.87 GABRB3 (0.37) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7027433 0.86 GABRP (0.46) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7028256 0.84 GABRB3 (0.36) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL5206943 0.84 GABRB3 (0.40) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7031386 0.83 GABRB3 (0.34) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7027169 0.83 GABRB3 (0.33) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7025818 0.82 GABRB3 (0.36) 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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6638956-B2 Pesticidal 1-arylpyrazoles RHONE-POULENC, INC. 2003-10-28 US claimed
US-20030144251-A1 Pesticidal 1-arylpyrazoles RHONE-POULENC INC. 2003-07-31 US claimed
EP-0948485-B1 PESTICIDAL 1-ARYLPYRAZOLES AVENTIS CROPSCIENCE SA (FR) 2002-09-25 EP claimed
US-20020045758-A1 Pesticidal 1-arylpyrazoles RHONE-POULENC INC. 2002-04-18 US claimed
US-6350771-B1 Pesticidal 1-arylpyrazoles RHONE-POULENC, INC. 2002-02-26 US claimed
EP-0948485-A1 PESTICIDAL 1-ARYLPYRAZOLES RHONE-POULENC AGROCHIMIE (FR) 1999-10-13 EP claimed
WO-1998028278-A1 PESTICIDAL 1-ARYLPYRAZOLES RHONE-POULENC AGROCHIMIE (FR) 1998-07-02 WO claimed
US-20030144251-A1 Pesticidal 1-arylpyrazoles RHONE-POULENC INC. 2003-07-31 US disclosed
US-6500850-B2 1-ARYLPYRAZOLE OXIME DERIVATIVES; SAFE SYSTEMIC INSECTICIDES FOR CONTROL OF ARTHROPOD, NEMATODE, HELMINTH OR PROTOZOAN PESTS RHONE-POULENC INC. 2002-12-31 US disclosed
EP-0948485-B1 PESTICIDAL 1-ARYLPYRAZOLES AVENTIS CROPSCIENCE SA (FR) 2002-09-25 EP disclosed
US-20020045758-A1 Pesticidal 1-arylpyrazoles RHONE-POULENC INC. 2002-04-18 US disclosed
US-6350771-B1 Pesticidal 1-arylpyrazoles RHONE-POULENC, INC. 2002-02-26 US disclosed
WO-1999017613-A1 METHODE OF INSECT CONTROL RHONE-POULENC AGRO (FR) 1999-04-15 WO 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-20020045758-A1 Pesticidal 1-arylpyrazoles CYP1B1, CYP2E1, CYP1A1 GABRB3 1485/4885GABRA2 2380/4885GABRB2 1699/4885
US-20030144251-A1 Pesticidal 1-arylpyrazoles CYP1B1, CYP2E1, CYP1A1 GABRB3 1485/4885GABRA2 2380/4885GABRB2 1699/4885

“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.