SCHEMBL16954199

SCHEMBL16954199

C=[C]c1cc(CC(C)C)cc(OC(F)F)c1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 3/20 0.36
▸ MEP1B Q16820 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
SCHEMBL16954880 0.84 RXRA (0.33) ACACB
SCHEMBL16951174 0.82 TAAR1 (0.38) —
SCHEMBL16960122 0.81 BACE1 (0.32) ACACB
SCHEMBL16958159 0.80 ACACB (0.35) ACACB
SCHEMBL16953683 0.79 ACACB (0.35) ACACB
SCHEMBL16960034 0.79 NQO1 (0.36) ACACB
SCHEMBL16954448 0.79 DRD1 (0.31) —
SCHEMBL16956242 0.79 GABRA1 (0.35) —
SCHEMBL16956266 0.79 PTGS2 (0.35) ACACB
SCHEMBL16955236 0.79 MEP1B (0.32) ACACBMEP1B

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
EP-2900645-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION Bayer CropScience AG (DE) 2015-08-05 — — EP disclosed
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