SCHEMBL795264

SCHEMBL795264

CCC(=O)NCc1ccc(N2CCC(c3cc(Cl)c(Cl)c(Cl)c3)(C(F)(F)F)C2O)cc1Br

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.35
NR1H4 Q96RI1 1/20 0.35
TRPV1 Q8NER1 13/20 0.33
P2RX7 Q99572 4/20 0.33
CYP2D6 P10635 1/20 0.31
PKM P14618 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL15474190 1.00 EPHX2 (0.35) EPHX2NR1H4TRPV1P2RX7CYP2D6
SCHEMBL807795 0.83 EPHX2 (0.38) EPHX2NR1H4TRPV1P2RX7
SCHEMBL27996842 0.83 ALDH1A1 (0.39) EPHX2NR1H4TRPV1P2RX7CYP2D6
SCHEMBL795090 0.82 TRPV1 (0.36) EPHX2NR1H4TRPV1P2RX7
SCHEMBL15474193 0.82 TRPV1 (0.36) EPHX2NR1H4TRPV1P2RX7
SCHEMBL794413 0.81 P2RX7 (0.39) EPHX2P2RX7
SCHEMBL807611 0.81 P2RX7 (0.39) EPHX2P2RX7
SCHEMBL12467208 0.81 TRPV1 (0.37) EPHX2NR1H4TRPV1P2RX7
SCHEMBL20633240 0.81 AR (0.42) EPHX2P2RX7CYP2D6PKMCYP2C19
SCHEMBL20631225 0.81 AR (0.42) EPHX2P2RX7CYP2D6PKMCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9375000-B2 Pesticidal arylpyrrolidines BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-06-28 US disclosed
US-20140046069-A1 PESTICIDAL ARYLPYRROLIDINES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-02-13 US disclosed
EP-2616437-A1 PESTICIDAL ARYLPYRROLIDINES Bayer Intellectual Property GmbH (DE) 2013-07-24 EP disclosed
WO-2012035011-A1 PESTICIDAL ARYLPYRROLIDINES BAYER CROPSCIENCE AG (DE) 2012-03-22 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 (1 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-20140046069-A1 PESTICIDAL ARYLPYRROLIDINES DDT, ACHE, CAT EPHX2 1332/4885NR1H4 3054/4885TRPV1 293/4885

“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.