SCHEMBL14129223

SCHEMBL14129223

CCOc1cc(C)cc(CC)c1C1=C(O)C2(CCC(OC)CC2)NC1=O

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACACB O00763 10/20 0.45
ACACA Q13085 10/20 0.45
GRM1 Q13255 1/20 0.31
TSHR P16473 1/20 0.30
BACE1 P56817 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
SCHEMBL13070822 0.92 ACACB (0.48) ACACBACACAGRM1BACE1
SCHEMBL13096250 0.91 ACACB (0.50) ACACBACACAGRM1BACE1
SCHEMBL1899703 0.90 ACACB (0.47) ACACBACACAGRM1TSHRBACE1
SCHEMBL3684010 0.90 ACACB (0.47) ACACBACACAGRM1TSHRBACE1
SCHEMBL13288540 0.88 ACACB (0.50) ACACBACACAGRM1BACE1
SCHEMBL14129268 0.86 ACACB (0.35) ACACBACACAGRM1TSHR
SCHEMBL14490553 0.86 ACACB (0.46) ACACBACACABACE1
SCHEMBL13960142 0.83 ACACB (0.42) ACACBACACAGRM1BACE1
SCHEMBL13328259 0.82 ACACB (0.41) ACACBACACATSHR
SCHEMBL14372083 0.82 ACACB (0.52) ACACBACACAGRM1BACE1

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
US-20080167188-A1 Herbicide Combinations Comprising Special Ketoenoles BAYER CROPSCIENCE AG (DE) 2008-07-10 US 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-20080167188-A1 Herbicide Combinations Comprising Special Ketoenoles DDT, NOTUM, CA3 ACACB 190/4885ACACA 396/4885GRM1 1315/4885

“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.