SCHEMBL4520775

SCHEMBL4520775

Cc1cc2c(cc1C)C(=O)CC1(CCN(C(=O)c3ccc4[nH]ncc4c3)CC1)O2

nearest known ligand 0.82

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACACB O00763 12/20 0.82
ACACA Q13085 2/20 0.82
KCNH2 Q12809 1/20 0.67

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
SCHEMBL4520477 0.93 ACACB (0.77) ACACBACACAKCNH2
Trifluoroacetic Acid SCHEMBL4261177 0.87 ACACB (0.65) ACACBACACAKCNH2
SCHEMBL4509544 0.86 ACACB (1.00) ACACB
SCHEMBL4507766 0.83 ACACB (0.60) ACACBACACAKCNH2
SCHEMBL4504145 0.83 ACACB (0.83) ACACB
SCHEMBL4519791 0.81 ACACB (0.62) ACACBACACA
SCHEMBL4268374 0.81 ACACB (0.60) ACACBACACA
Trifluoroacetic Acid SCHEMBL4264817 0.81 ACACB (0.88) ACACBACACA
SCHEMBL4509550 0.81 ACACB (1.00) ACACBACACA
SCHEMBL12903889 0.80 ACACB (1.00) ACACBACACAKCNH2

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-20090270435-A1 Spiroketone Acetyl-CoA Carboxylase Inhibitors CORBETT JEFFREY WAYNE 2009-10-29 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-20090270435-A1 Spiroketone Acetyl-CoA Carboxylase Inhibitors ACACA, PC, ACACB ACACB 3/4885ACACA 1/4885KCNH2 980/4885

“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.