SCHEMBL793911

SCHEMBL793911

CC(=O)NCc1ccc(N2CCC(c3cc(Cl)cc(Cl)c3)(C(F)(F)F)C2)cc1Br

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.36
NR1H4 Q96RI1 2/20 0.36
PTGS2 P35354 1/20 0.34
CCR1 P32246 1/20 0.32
NR1H2 P55055 2/20 0.32
NR1H3 Q13133 2/20 0.32
SETDB1 Q15047 1/20 0.32
METAP2 P50579 1/20 0.32
DDR1 Q08345 3/20 0.32
DRD2 P14416 1/20 0.31
DRD4 P21917 1/20 0.31
KCNH2 Q12809 2/20 0.31
PTPN1 P18031 1/20 0.31
ENPP2 Q13822 1/20 0.31
NOTUM Q6P988 1/20 0.31
MALT1 Q9UDY8 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
SCHEMBL794817 0.92 EPHX2 (0.40) EPHX2NR1H4PTGS2CCR1NR1H2
SCHEMBL794207 0.91 EPHX2 (0.35) EPHX2NR1H4DDR1ENPP2
SCHEMBL539828 0.91 EPHX2 (0.43) EPHX2NR1H4KCNH2ENPP2NOTUM
SCHEMBL540749 0.90 EPHX2 (0.37) EPHX2NR1H4PTGS2CCR1NR1H2
SCHEMBL15468119 0.89 TRPV1 (0.38) EPHX2NR1H4DDR1KCNH2ENPP2
SCHEMBL17857813 0.88 EPHX2 (0.41) EPHX2KCNH2
SCHEMBL794733 0.83 EPHX2 (0.36) EPHX2NR1H4PTGS2CCR1NR1H2
SCHEMBL540353 0.83 AR (0.31)
SCHEMBL794407 0.83 EPHX2 (0.45) EPHX2NR1H4CCR1KCNH2ENPP2
SCHEMBL794436 0.83 EPHX2 (0.39) EPHX2NR1H4ENPP2

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 5 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
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 3054/4885PTGS2 1352/4885

“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.