SCHEMBL12467308

SCHEMBL12467308

O=C(O)NCc1ccc(N2CCC(c3cc(C(F)(F)F)cc(C(F)(F)F)c3)(C(F)(F)F)C2O)nc1Br

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 8/20 0.36
CCR2 P41597 8/20 0.34
TACR1 P25103 4/20 0.34
KCNH2 Q12809 5/20 0.33

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
SCHEMBL794134 0.91 TRPV1 (0.37) TRPV1CCR2TACR1
SCHEMBL795181 0.88 CACNA1H (0.39) TRPV1CCR2TACR1
SCHEMBL794066 0.85
SCHEMBL807885 0.85
SCHEMBL12467244 0.83 TACR1 (0.32) TACR1
SCHEMBL794922 0.80 KCNH2 (0.37) KCNH2
SCHEMBL12467260 0.79 TACR1 (0.35) TRPV1TACR1
SCHEMBL15474193 0.74 TRPV1 (0.36) TRPV1
SCHEMBL795090 0.74 TRPV1 (0.36) TRPV1
SCHEMBL12467208 0.73 TRPV1 (0.37) TRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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