SCHEMBL22601423

SCHEMBL22601423

CCC(C)(C)C(=O)OC[C@@H](C)C(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.35
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 0.34
HMGCR P04035 2/20 0.33
MMP8 P22894 1/20 0.33

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
SCHEMBL25519506 0.85 PRKCA (0.33) PRKCACYP4F2CYP4A11HMGCRMMP8
SCHEMBL14827375 0.84 HMGCR (0.38) PRKCACYP4F2CYP4A11HMGCRMMP8
SCHEMBL2681051 0.84 PRKCA (0.35) PRKCACYP4F2CYP4A11HMGCRMMP8
SCHEMBL2681020 0.83 TSHR (0.42) PRKCACYP4F2CYP4A11HMGCRMMP8
SCHEMBL14769605 0.83 PRKCA (0.37) PRKCACYP4F2CYP4A11HMGCRMMP8
SCHEMBL22601580 0.82 CYP4F2 (0.34) PRKCACYP4F2CYP4A11HMGCR
SCHEMBL6380226 0.82 MAPT (0.43) PRKCACYP4F2CYP4A11HMGCRMMP8
SCHEMBL15451564 0.80 CYP4F2 (0.33) PRKCACYP4F2CYP4A11
SCHEMBL8988305 0.80 MAPT (0.42) PRKCACYP4F2CYP4A11HMGCRMMP8
SCHEMBL14195308 0.80 HMGCR (0.35) PRKCACYP4F2CYP4A11HMGCRMMP8

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-20200339530-A1 UREA DERIVATIVES AS INHIBITORS OF ASK1 HEPAGENE THERAPEUTICS, INC. (VG) 2020-10-29 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-20200339530-A1 UREA DERIVATIVES AS INHIBITORS OF ASK1 ATF1, ERN1, MAP3K1 PRKCA 204/4885CYP4F2 4059/4885CYP4A11 2434/4885

“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.