SCHEMBL13103286

SCHEMBL13103286

CCOC(=O)OC1=C(c2c(C)cc(Cl)cc2C)C(=O)N[C@]12CC[C@](C)(OC)CC2

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACACB O00763 8/20 0.48
ACACA Q13085 8/20 0.48
ABCB1 P08183 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
SCHEMBL15910066 1.00 ACACB (0.48) ACACBACACAABCB1
SCHEMBL16131089 0.92 ACACB (0.49) ACACBACACA
SCHEMBL13103282 0.88 ACACB (0.48) ACACBACACA
SCHEMBL15910065 0.88 ACACB (0.48) ACACBACACA
SCHEMBL15300245 0.84 ACACB (0.35) ACACBACACA
SCHEMBL13103234 0.84 ACACB (0.41) ACACBACACAABCB1
SCHEMBL15472957 0.82 ACACB (0.33) ACACBACACAABCB1
SCHEMBL13103226 0.81 ACACB (0.38) ACACBACACA
SCHEMBL13117629 0.81 ACACB (0.48) ACACBACACA
SCHEMBL12362050 0.79 NPC1 (0.31) ACACBACACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2373619-B1 GEMINAL ALKOXY/ALKYLSPIROCYCLIC SUBSTITUTED TETRAMIC ACID DERIVATES BAYER CROPSCIENCE AG (DE) 2014-09-10 EP disclosed
US-8389443-B2 Geminal alkoxy/alkylspirocyclic substituted tetramate derivatives BAYER CROPSCIENCE AG (DE) 2013-03-05 US disclosed
US-8389443-B2 Geminal alkoxy/alkylspirocyclic substituted tetramate derivatives BAYER CROPSCIENCE AG (DE) 2013-03-05 US disclosed
US-20100261608-A1 Geminal alkoxy/alkylspirocyclic substituted tetramate derivatives BAYER CROPSCIENCE AG (DE) 2010-10-14 US disclosed
WO-2010063378-A1 GEMINAL ALKOXY/ALKYLSPIROCYCLIC SUBSTITUTED TETRAMIC ACID DERIVATES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2010-06-10 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100261608-A1 Geminal alkoxy/alkylspirocyclic substituted tetramate derivatives GMNN, AGXT, GEMIN5 ACACB 643/4885ACACA 281/4885ABCB1 373/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.