SCHEMBL5537539

SCHEMBL5537539

CC(C)(C)OC(=O)C[C@H]1CC[C@H](c2ccc(-c3cnc(N)c(C(N)=O)n3)cc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 19/20 0.61
SOAT1 P35610 4/20 0.46
FAAH O00519 1/20 0.46
CHRM2 P08172 1/20 0.46
DGAT2 Q96PD7 1/20 0.46
PDE10A Q9Y233 1/20 0.46
ACVR2A P27037 1/20 0.40
TGFBR2 P37173 1/20 0.40

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
SCHEMBL2255423 0.92 DGAT1 (0.56) DGAT1SOAT1FAAHCHRM2DGAT2
SCHEMBL2255419 0.92 DGAT1 (0.56) DGAT1SOAT1FAAHCHRM2DGAT2
SCHEMBL2258532 0.85 DGAT1 (0.78) DGAT1SOAT1FAAHCHRM2DGAT2
SCHEMBL2258528 0.85 DGAT1 (0.78) DGAT1SOAT1FAAHCHRM2DGAT2
Hydrochloric Acid SCHEMBL2255386 0.84 DGAT1 (0.77) DGAT1SOAT1FAAHCHRM2DGAT2
Hydrochloric Acid SCHEMBL2255383 0.84 DGAT1 (0.77) DGAT1SOAT1FAAHCHRM2DGAT2
SCHEMBL5537381 0.82 DGAT1 (0.74) DGAT1SOAT1FAAHCHRM2DGAT2
SCHEMBL2255755 0.79 DGAT1 (0.79) DGAT1SOAT1FAAHCHRM2DGAT2
SCHEMBL2255759 0.79 DGAT1 (0.79) DGAT1SOAT1FAAHCHRM2DGAT2
SCHEMBL5534475 0.78 DGAT1 (0.76) DGAT1SOAT1FAAHCHRM2DGAT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120108602-A1 Carbamoyl Compounds as DGAT1 Inhibitors 190 ASTRAZENECA AB (SE) 2012-05-03 US disclosed
US-20120108602-A1 Carbamoyl Compounds as DGAT1 Inhibitors 190 ASTRAZENECA AB (SE) 2012-05-03 US disclosed
US-7994179-B2 Carbamoyl compounds as DGAT1 inhibitors 190 ASTRAZENECA AB (SE) 2011-08-09 US disclosed
US-20090298853-A1 Carbamoyl Compounds as DGAT1 Inhibitors 190 ASTRAZENECA AB (SE) 2009-12-03 US disclosed
WO-2009081195-A1 CARBAMOYL COMPOUNDS AS DGAT1 INHIBITORS 190 ASTRAZENECA AB (SE) 2009-07-02 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 (2 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-20120108602-A1 Carbamoyl Compounds as DGAT1 Inhibitors 190 DGAT1, DGAT2, SOAT1 DGAT1 1/4885SOAT1 3/4885FAAH 979/4885
US-20090298853-A1 Carbamoyl Compounds as DGAT1 Inhibitors 190 DGAT1, DGAT2, SOAT1 DGAT1 1/4885SOAT1 3/4885FAAH 898/4885

“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.