SCHEMBL794922

SCHEMBL794922

O=C(O)NCc1ccc(N2CCC(c3cc(C(F)(F)F)cc(C(F)(F)F)c3)(C(F)(F)F)C2O)cc1Cl

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.37
MCHR1 Q99705 2/20 0.37
LMNA P02545 1/20 0.37
EPHX2 P34913 6/20 0.36
NR1H4 Q96RI1 2/20 0.36
P2RX7 Q99572 9/20 0.36
HSD11B1 P28845 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
SCHEMBL794992 0.90 KCNH2 (0.46) KCNH2MCHR1EPHX2P2RX7
SCHEMBL807608 0.90 KCNH2 (0.46) KCNH2MCHR1EPHX2P2RX7
SCHEMBL807583 0.88 ALDH1A1 (0.38) KCNH2MCHR1LMNAEPHX2NR1H4
SCHEMBL794562 0.84 AR (0.31)
SCHEMBL12467308 0.80 TRPV1 (0.36) KCNH2
SCHEMBL808171 0.79 ALDH1A1 (0.37) KCNH2MCHR1EPHX2NR1H4P2RX7
SCHEMBL12467058 0.79 METAP2 (0.40) KCNH2MCHR1LMNAEPHX2NR1H4
SCHEMBL17874618 0.77 P2RX7 (0.37) EPHX2P2RX7
SCHEMBL17874617 0.76 AR (0.42) KCNH2MCHR1EPHX2P2RX7
SCHEMBL15474190 0.76 EPHX2 (0.35) EPHX2NR1H4P2RX7

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 KCNH2 177/4885MCHR1 1165/4885LMNA 4333/4885

“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.