SCHEMBL16790076

SCHEMBL16790076

COC(=O)C(C)(C)COc1cc(C)c(-c2cnc(C(=N)N)nc2)cn1

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 2/20 0.46
DGAT1 O75907 18/20 0.46

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
SCHEMBL16787610 0.89 DGAT1 (0.48) DGAT1
SCHEMBL15293916 0.87 DGAT1 (0.46) AAK1DGAT1
SCHEMBL10177236 0.87 DGAT1 (0.48) AAK1DGAT1
SCHEMBL15293797 0.87 DGAT1 (0.49) AAK1DGAT1
SCHEMBL10177482 0.85 DGAT1 (0.48) AAK1DGAT1
SCHEMBL10176535 0.83 DGAT1 (0.50) AAK1DGAT1
SCHEMBL10176498 0.83 DGAT1 (0.51) DGAT1
SCHEMBL16787631 0.81 DGAT1 (0.43) AAK1DGAT1
SCHEMBL16660838 0.81 TMPRSS15 (0.35) AAK1DGAT1
Acetic Acid SCHEMBL9936352 0.80 DGAT1 (0.51) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10308636-B2 Aromatic heterocyclic compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2019-06-04 US disclosed
EP-2862856-B1 IMIDAZOLE AND TRIAZOLE COMPOUNDS AS DGAT-1 INHIBITORS MITSUBISHI TANABE PHARMA CORP (JP) 2018-08-01 EP disclosed
US-20170050950-A1 AROMATIC HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2017-02-23 US disclosed
US-9546155-B2 Aromatic heterocyclic compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2017-01-17 US disclosed
US-20150158844-A1 AROMATIC HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-06-11 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 (3 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-20150158844-A1 AROMATIC HETEROCYCLIC COMPOUND GPR119, NR0B1, BET1 AAK1 2148/4885DGAT1 1688/4885
US-10308636-B2 Aromatic heterocyclic compound GPR119, NR0B1, BET1 AAK1 2148/4885DGAT1 1688/4885
US-20170050950-A1 AROMATIC HETEROCYCLIC COMPOUND GPR119, NR0B1, BET1 AAK1 2148/4885DGAT1 1688/4885

“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.