SCHEMBL16581663

SCHEMBL16581663

CON1CCC2(CC1)NC(=O)C(c1cc(C)ccc1C)=C2OC(=O)O

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 13/20 0.40
▸ ACACA Q13085 13/20 0.40
▸ MEN1 O00255 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ THRB P10828 1/20 0.32
▸ FFAR4 Q5NUL3 1/20 0.31
▸ ABL1 P00519 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
SCHEMBL30204267 1.00 ACACB (0.40) ACACBACACAMEN1ALDH1A1HPGD
SCHEMBL2759751 0.92 ACACB (0.38) ACACBACACAMEN1ALDH1A1HPGD
SCHEMBL248519 0.91 ACACB (0.37) ACACBACACAMEN1KMT2ATHRB
SCHEMBL2759752 0.89 ACACB (0.38) ACACBACACAMEN1KMT2ATHRB
SCHEMBL251850 0.89 ACACB (0.38) ACACBACACAMEN1ALDH1A1KMT2A
SCHEMBL2759742 0.89 ACACB (0.36) ACACBACACAKMT2ATHRB
SCHEMBL29836257 0.89 ACACB (0.38) ACACBACACAMEN1ALDH1A1KMT2A
SCHEMBL2759764 0.89 ACACB (0.36) ACACBACACAKMT2ATHRB
SCHEMBL2759740 0.88 ACACB (0.39) ACACBACACAKMT2ATHRB
SCHEMBL2759737 0.87 POLB (0.36) ACACBACACAALDH1A1THRB

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-2352375-B1 HERBICIDAL COMPOSITIONS SYNGENTA PARTICIPATIONS AG (CH) 2015-03-25 — — EP disclosed
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