SCHEMBL10147191

SCHEMBL10147191

CCCc1cc(COCC(C)C)on1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.38
HPGD P15428 1/20 0.38
PPARA Q07869 1/20 0.37
AURKA O14965 1/20 0.32
DAPK3 O43293 1/20 0.32
JAK2 O60674 1/20 0.32
ROCK2 O75116 1/20 0.32
CHEK2 O96017 1/20 0.32
PIM1 P11309 1/20 0.32
CDK2 P24941 1/20 0.32
MARK3 P27448 1/20 0.32
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
LIMK1 P53667 1/20 0.32
CDK5 Q00535 1/20 0.32
ROCK1 Q13464 1/20 0.32
DYRK1A Q13627 1/20 0.32
AURKB Q96GD4 1/20 0.32
PRKD2 Q9BZL6 1/20 0.32
OPRM1 P35372 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
SCHEMBL12231974 0.91 PPARA (0.44) RAB9AHPGDPPARA
SCHEMBL12436967 0.87 RAB9A (0.36) RAB9AHPGDPPARANPC1MEN1
SCHEMBL10119383 0.85 PPARA (0.35) PPARA
SCHEMBL10120844 0.84 MAPK1 (0.35) RAB9ADAPK3JAK2ROCK2CDK2
SCHEMBL19364783 0.78 RAB9A (0.42) RAB9AHPGDPPARAAURKADAPK3
SCHEMBL1715078 0.77 PPARA (0.40) RAB9AHPGDPPARAAURKADAPK3
SCHEMBL18949082 0.75 CDC7 (0.34) RAB9AHPGDPPARADAPK3JAK2
SCHEMBL10141470 0.74 PPARA (0.48) PPARAMEN1KMT2AALDH1A1TSHR
SCHEMBL12450498 0.74 PPARA (0.45) RAB9AHPGDPPARAAURKADAPK3
SCHEMBL20427474 0.71 RAB9A (0.49) RAB9AHPGDPPARADAPK3JAK2

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-20120076755-A1 Hepatitis C Virus Inhibitors ENANTA PHARMACEUTICALS, INC. 2012-03-29 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-20120076755-A1 Hepatitis C Virus Inhibitors NSUN2, HCCS, HAVCR2 RAB9A 2060/4885HPGD 2627/4885PPARA 1629/4885

“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.