SCHEMBL798376

SCHEMBL798376

N[C@@H](Cc1ccc(N2CCC(c3cc(Cl)c(Cl)c(Cl)c3)(C(F)(F)F)C2)cc1Br)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MC4R P32245 1/20 0.31
TNF P01375 1/20 0.31
EPHX2 P34913 1/20 0.30
NR1H4 Q96RI1 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
SCHEMBL807612 0.84 SCD (0.32) EPHX2NR1H4
SCHEMBL794884 0.84 AR (0.30)
SCHEMBL794817 0.81 EPHX2 (0.40) EPHX2NR1H4
SCHEMBL794436 0.80 EPHX2 (0.39) EPHX2NR1H4
SCHEMBL15474192 0.79
SCHEMBL794609 0.79 EPHX2 (0.40) EPHX2NR1H4
SCHEMBL15465957 0.77
SCHEMBL798759 0.76 AR (0.30)
SCHEMBL539934 0.75 AR (0.31)
SCHEMBL807795 0.75 EPHX2 (0.38) EPHX2NR1H4

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