SCHEMBL12745124

SCHEMBL12745124

CC(=O)NC1CCc2cc(C3=NCC(c4cc(Cl)cc(Cl)c4)(C(F)(F)F)C3)ccc21

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
BDKRB1 P46663 17/20 0.39
TRPV1 Q8NER1 1/20 0.35
P2RX7 Q99572 1/20 0.35

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
SCHEMBL327626 0.92 CA12 (0.40) CA12CA1CA2CA7CA9
SCHEMBL3462517 0.92 BDKRB1 (0.40) BDKRB1P2RX7
SCHEMBL15516994 0.91 BDKRB1 (0.42) BDKRB1TRPV1P2RX7
SCHEMBL15516270 0.91 CYP11B2 (0.40) BDKRB1
SCHEMBL15516909 0.90 CA12 (0.38) CA12CA1CA2CA7CA9
SCHEMBL12745306 0.89 BDKRB1 (0.46) BDKRB1
SCHEMBL12745005 0.89 BDKRB1 (0.37) BDKRB1TRPV1
SCHEMBL1465860 0.89 TRPV1 (0.41) BDKRB1TRPV1
SCHEMBL807572 0.83 CYP11B2 (0.41) BDKRB1
SCHEMBL325428 0.82 BDKRB1 (0.39) CA12CA1CA2CA7CA9

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150208658-A1 METHODS OF SOIL PEST CONTROL SYNGENTA PARTICIPATIONS AG (CH) 2015-07-30 US disclosed
US-20150189884-A1 METHODS OF CONTROLLING INSECTS SYNGENTA PARTICIPATIONS AG (CH) 2015-07-09 US disclosed
EP-2887802-A2 METHODS OF SOIL PEST CONTROL Syngenta Participations AG (CH) 2015-07-01 EP disclosed
US-20150152070-A1 METHODS OF PEST CONTROL IN SOYBEAN SYNGENTA PARICIPATIONS AG (CH) 2015-06-04 US disclosed
WO-2014029710-A2 METHODS OF SOIL PEST CONTROL SYNGENTA PARTICIPATIONS AG (CH) 2014-02-27 WO disclosed
WO-2014029707-A1 METHODS OF CONTROLLING INSECTS SYNGENTA PARTICIPATIONS AG (CH) 2014-02-27 WO disclosed
WO-2014029708-A1 METHODS OF CONTROLLING INSECTS SYNGENTA PARTICIPATIONS AG (CH) 2014-02-27 WO disclosed
WO-2014029706-A2 METHODS OF CONTROLLING INSECTS SYNGENTA PARTICIPATIONS AG (CH) 2014-02-27 WO disclosed
WO-2014019957-A2 METHODS OF PEST CONTROL IN SOYBEAN SYNGENTA PARTICIPATIONS AG (CH) 2014-02-06 WO disclosed
US-20110071141-A1 Pesticidial Condensed-Ring Aryl Compounds BAYER CROPSCIENCE AG 2011-03-24 US 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 (4 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-20110071141-A1 Pesticidial Condensed-Ring Aryl Compounds DDT, PRDX4, CYP4X1 CA12 4333/4885CA1 2747/4885CA2 2237/4885
US-20150189884-A1 METHODS OF CONTROLLING INSECTS CBR3, C5, CNPY3 CA12 1769/4885CA1 1402/4885CA2 597/4885
US-20150152070-A1 METHODS OF PEST CONTROL IN SOYBEAN C1S, ATL3, CCNB3 CA12 2374/4885CA1 1821/4885CA2 1191/4885
US-20150208658-A1 METHODS OF SOIL PEST CONTROL C1S, CBR3, CNPY3 CA12 1643/4885CA1 499/4885CA2 441/4885

“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.