SCHEMBL807611

SCHEMBL807611

CCC(=O)NCc1ccc(N2CCC(c3cc(Cl)cc(Cl)c3)(C(F)(F)F)C2O)cc1C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 7/20 0.39
EPHX2 P34913 3/20 0.38
DDR1 Q08345 9/20 0.37
KCNH2 Q12809 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
SCHEMBL794413 1.00 P2RX7 (0.39) P2RX7EPHX2DDR1KCNH2
SCHEMBL15467820 0.95 P2RX7 (0.40) P2RX7EPHX2DDR1KCNH2
SCHEMBL17874615 0.90 EPHX2 (0.45) P2RX7EPHX2KCNH2
SCHEMBL17874614 0.88 DDR1 (0.38) P2RX7EPHX2DDR1
SCHEMBL15474191 0.84 P2RX7 (0.38) P2RX7EPHX2DDR1
SCHEMBL794251 0.84 P2RX7 (0.38) P2RX7EPHX2DDR1
SCHEMBL17874619 0.83 CYP2D6 (0.40) EPHX2KCNH2
SCHEMBL17874618 0.82 P2RX7 (0.37) P2RX7EPHX2DDR1
SCHEMBL15474190 0.81 EPHX2 (0.35) P2RX7EPHX2
SCHEMBL795264 0.81 EPHX2 (0.35) P2RX7EPHX2

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-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
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 P2RX7 750/4885EPHX2 1332/4885DDR1 4208/4885

“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.