SCHEMBL17211816

SCHEMBL17211816

C=C(/C=C\C(=C)[N+](=O)[O-])c1ccc2c(c1)CCC(OC)C2=O

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CYP26A1 O43174 1/20 0.31
▸ CYP24A1 Q07973 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP2C19 P33261 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
SCHEMBL17211813 0.84 CYP26A1 (0.32) CYP26A1
SCHEMBL17211810 0.76 MAOA (0.44) —
SCHEMBL17211819 0.76 PDE4D (0.31) —
SCHEMBL17211806 0.76 PDE4D (0.31) —
SCHEMBL17211805 0.71 SIRT2 (0.30) —
SCHEMBL17211800 0.70 CYP2A6 (0.35) CYP1A2CYP2C19
SCHEMBL14059679 0.69 TDP2 (0.39) —
SCHEMBL17211822 0.69 KDM1A (0.33) —
SCHEMBL17211807 0.68 ALDH1A1 (0.33) —
SCHEMBL22867686 0.67 CYP24A1 (0.55) CYP26A1CYP24A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9242929-B2 Compounds as diacylglycerol acyltransferase inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2016-01-26 — — US disclosed
US-20150307445-A1 Novel Compounds as Diacylglycerol Acyltransferase Inhibitors GlaxoSmith Kline Intellectual Property (No.2) Limited (GB) 2015-10-29 — — 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-20150307445-A1 Novel Compounds as Diacylglycerol Acyltransferase Inhibitors DGAT1, DGAT2, LCAT CYP26A1 861/4885CYP24A1 1522/4885CYP1A2 1228/4885

“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.

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