SCHEMBL14137073

SCHEMBL14137073

CCOC(=O)C(C)(C)C1CCc2cc(OS(=O)(=O)C(F)(F)F)ccc2C1=O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 2/20 0.44
▸ DRD3 P35462 2/20 0.44
▸ HTR1D P28221 1/20 0.44
▸ CYP24A1 Q07973 6/20 0.41
▸ CYP27A1 Q02318 3/20 0.41
▸ CYP26A1 O43174 3/20 0.41
▸ ACHE P22303 6/20 0.37
▸ CYP19A1 P11511 1/20 0.37
▸ ADORA1 P30542 1/20 0.37
▸ DRD1 P21728 1/20 0.36
▸ DRD4 P21917 1/20 0.36
▸ DRD5 P21918 1/20 0.36
▸ HSD11B1 P28845 1/20 0.35

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
SCHEMBL14062029 0.87 CYP24A1 (0.49) DRD2CYP24A1CYP27A1CYP26A1ACHE
SCHEMBL17211830 0.83 PARP10 (0.39) CYP24A1CYP27A1CYP26A1ACHE
SCHEMBL14137074 0.82 CYP26A1 (0.46) CYP24A1CYP26A1CYP19A1
SCHEMBL14061800 0.81 CYP24A1 (0.48) DRD2DRD3HTR1DCYP24A1CYP27A1
SCHEMBL14062048 0.80 CYP24A1 (0.47) DRD2DRD3HTR1DCYP24A1CYP27A1
SCHEMBL2472482 0.79 CYP24A1 (0.50) DRD2CYP24A1CYP27A1CYP26A1ACHE
SCHEMBL14062034 0.78 CYP26A1 (0.39) CYP24A1CYP26A1
SCHEMBL1500201 0.76 DRD2 (0.47) DRD2DRD3HTR1DCYP24A1CYP27A1
SCHEMBL14137078 0.76 ITGB3 (0.56) CYP24A1CYP27A1CYP26A1CYP19A1
SCHEMBL14062072 0.75 ALDH1A1 (0.39) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2723332-B1 NOVEL COMPOUNDS AS DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS GLAXOSMITHKLINE IP NO 2 LTD (GB) 2016-03-02 — — EP disclosed
EP-2723332-B1 NOVEL COMPOUNDS AS DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS GLAXOSMITHKLINE IP NO 2 LTD (GB) 2016-03-02 — — EP disclosed
US-9242929-B2 Compounds as diacylglycerol acyltransferase inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2016-01-26 — — US disclosed
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
US-20150307445-A1 Novel Compounds as Diacylglycerol Acyltransferase Inhibitors GlaxoSmith Kline Intellectual Property (No.2) Limited (GB) 2015-10-29 — — US disclosed
WO-2012162127-A1 NOVEL COMPOUNDS AS DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2012-11-29 — — WO 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 DRD2 2863/4885DRD3 2151/4885HTR1D 4102/4885

“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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