SCHEMBL14062073

SCHEMBL14062073

CCOC(=O)C(C)C1(C)CCc2cc(-c3ccc([N+](=O)[O-])cc3)ccc2C1=O

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ LMNA P02545 2/20 0.43
▸ PKM P14618 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ DGAT1 O75907 9/20 0.41
▸ CRHBP P24387 1/20 0.40
▸ CRHR2 Q13324 1/20 0.40
▸ HRH2 P25021 1/20 0.39
▸ HRH1 P35367 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ PRKCZ Q05513 1/20 0.38
▸ GAA P10253 1/20 0.38

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
SCHEMBL14061988 0.81 DGAT1 (0.50) MAPTALDH1A1LMNAPKMHTT
SCHEMBL14061881 0.80 ALDH1A1 (0.43) MAPTALDH1A1LMNAPKMHTT
SCHEMBL14061748 0.80 DGAT1 (0.54) MAPTALDH1A1LMNAPKMHTT
SCHEMBL14061838 0.78 ALDH1A1 (0.42) MAPTALDH1A1LMNAPKMHTT
SCHEMBL14061937 0.76 DGAT1 (0.53) MAPTALDH1A1LMNAPKMHTT
SCHEMBL14137094 0.76 DGAT1 (0.55) DGAT1
SCHEMBL17211801 0.74 SMN1; SMN2 (0.43) MAPTALDH1A1LMNAPKMHTT
SCHEMBL14061930 0.73 DGAT1 (0.48) DGAT1
SCHEMBL14061955 0.73 DGAT1 (0.45) MAPTALDH1A1LMNAPKMHTT
SCHEMBL14137109 0.72 DGAT1 (0.49) DGAT1

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 3 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-A1 NOVEL COMPOUNDS AS DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS Glaxosmithkline Intellectual Property (No. 2) Limited (GB) 2014-04-30 — — EP disclosed
WO-2012162127-A1 NOVEL COMPOUNDS AS DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2012-11-29 — — WO disclosed
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