SCHEMBL4101945

SCHEMBL4101945

COc1ccc(-c2ccc3c(c2)CCC(CC(=O)O)C3=O)cc1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.64
CYP24A1 Q07973 6/20 0.57
CYP26A1 O43174 4/20 0.57
CYP27A1 Q02318 3/20 0.54
CYP19A1 P11511 1/20 0.54
ITGB3 P05106 5/20 0.53
ITGA2B P08514 5/20 0.53
PPARD Q03181 3/20 0.53

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
SCHEMBL13774777 1.00 DGAT1 (0.64) DGAT1CYP24A1CYP26A1CYP27A1CYP19A1
SCHEMBL4621871 0.90 CYP24A1 (0.68) DGAT1CYP24A1CYP26A1CYP27A1CYP19A1
SCHEMBL4096787 0.86 CYP24A1 (0.50) DGAT1CYP24A1CYP26A1CYP27A1CYP19A1
SCHEMBL13774776 0.86 CYP24A1 (0.50) DGAT1CYP24A1CYP26A1CYP27A1CYP19A1
SCHEMBL7295884 0.83 CYP19A1 (0.65) CYP24A1CYP26A1CYP27A1CYP19A1ITGB3
SCHEMBL9855296 0.79 CYP24A1 (0.63) CYP24A1CYP26A1CYP27A1CYP19A1ITGB3
SCHEMBL14060281 0.79 DGAT1 (0.84) DGAT1ITGB3ITGA2B
SCHEMBL8536553 0.78 DGAT1 (0.57) DGAT1CYP24A1CYP26A1CYP27A1CYP19A1
SCHEMBL14061883 0.78 DGAT1 (1.00) DGAT1CYP26A1ITGB3ITGA2B
SCHEMBL4621209 0.78 CYP24A1 (0.65) CYP24A1CYP26A1CYP27A1CYP19A1

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-20090186900-A1 COMPOUND STERIX LIMITED (GB) 2009-07-23 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-20090186900-A1 COMPOUND HSD17B2, HSD17B11, CYP17A1 DGAT1 1072/4885CYP24A1 50/4885CYP26A1 37/4885

“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.