SCHEMBL794705

SCHEMBL794705

CCC(=O)NCc1ccc(N2CCC(c3cc(Cl)c(F)c(Cl)c3F)(C(F)(F)F)C2)cc1Br

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 5/20 0.35
NR1H4 Q96RI1 5/20 0.35
P2RX7 Q99572 4/20 0.33
TRPV1 Q8NER1 7/20 0.32
PDK2 Q15119 1/20 0.31
HSD11B1 P28845 1/20 0.30
ENPP2 Q13822 1/20 0.30

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
SCHEMBL793993 0.93 EPHX2 (0.40) EPHX2NR1H4P2RX7TRPV1HSD11B1
SCHEMBL794733 0.92 EPHX2 (0.36) EPHX2NR1H4P2RX7PDK2ENPP2
SCHEMBL798188 0.90 TRPV1 (0.35) EPHX2NR1H4P2RX7TRPV1ENPP2
SCHEMBL798252 0.89 EPHX2 (0.38) EPHX2P2RX7
SCHEMBL794436 0.86 EPHX2 (0.39) EPHX2NR1H4P2RX7TRPV1PDK2
SCHEMBL794207 0.84 EPHX2 (0.35) EPHX2NR1H4P2RX7TRPV1ENPP2
SCHEMBL15466565 0.84 EPHX2 (0.41) EPHX2NR1H4P2RX7TRPV1ENPP2
SCHEMBL807795 0.84 EPHX2 (0.38) EPHX2NR1H4P2RX7TRPV1PDK2
SCHEMBL794327 0.82 TRPV1 (0.36) EPHX2NR1H4P2RX7TRPV1
SCHEMBL794374 0.82 ENPP2 (0.37) EPHX2NR1H4P2RX7TRPV1ENPP2

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 3 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
CN-103282347-B Pesticidal arylpyrrolidines BAYER IP GMBH 2015-04-01 CN disclosed
US-20140046069-A1 PESTICIDAL ARYLPYRROLIDINES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-02-13 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 (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 3054/4885P2RX7 750/4885

“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.