SCHEMBL324862

SCHEMBL324862

CCC(=O)NC1CCc2cc(C3=NCC(c4cc(Cl)c(Cl)c(C(F)(F)F)c4)(C(F)(F)F)C3)ccc21

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 17/20 0.41
CYP11B1 P15538 15/20 0.41
BDKRB1 P46663 3/20 0.36

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
SCHEMBL807572 0.94 CYP11B2 (0.41) CYP11B2CYP11B1BDKRB1
SCHEMBL15516270 0.89 CYP11B2 (0.40) CYP11B2CYP11B1BDKRB1
SCHEMBL326134 0.89 CYP11B2 (0.45) CYP11B2CYP11B1
SCHEMBL326937 0.86 BDKRB1 (0.36) CYP11B2CYP11B1BDKRB1
SCHEMBL324952 0.86 BDKRB1 (0.37) CYP11B2CYP11B1BDKRB1
SCHEMBL327626 0.85 CA12 (0.40) CYP11B2CYP11B1BDKRB1
SCHEMBL325428 0.85 BDKRB1 (0.39) BDKRB1
SCHEMBL12745005 0.81 BDKRB1 (0.37) BDKRB1
SCHEMBL12745124 0.80 CA12 (0.41) BDKRB1
SCHEMBL1465860 0.79 TRPV1 (0.41) CYP11B2CYP11B1BDKRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012004326-A1 PESTICIDAL PYRROLINE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2012-01-12 WO disclosed