SCHEMBL325852

SCHEMBL325852

[CH2]CC1=C(c2cc(C)ccc2C)C(=O)NC12CCN(OC)CC2

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACACB O00763 11/20 0.39
ACACA Q13085 11/20 0.39
KMT2A Q03164 1/20 0.33
THRB P10828 1/20 0.31

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
SCHEMBL4609822 0.84 ACACB (0.51) ACACBACACAKMT2ATHRB
SCHEMBL4609825 0.84 ACACB (0.51) ACACBACACAKMT2ATHRB
SCHEMBL28990890 0.84 FFAR1 (0.38) ACACBACACAKMT2ATHRB
SCHEMBL2441549 0.83 ACACB (0.37) ACACBACACAKMT2ATHRB
SCHEMBL28647123 0.83 ACACB (0.35) ACACBACACAKMT2ATHRB
SCHEMBL249181 0.83 ACACB (0.53) ACACBACACAKMT2ATHRB
SCHEMBL2759740 0.83 ACACB (0.39) ACACBACACAKMT2ATHRB
SCHEMBL29735375 0.83 ACACB (0.53) ACACBACACAKMT2ATHRB
SCHEMBL2441551 0.83 ACACB (0.37) ACACBACACAKMT2ATHRB
SCHEMBL2759801 0.82 ACACB (0.39) ACACBACACAKMT2A

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