SCHEMBL18541103

SCHEMBL18541103

CCOC(=O)c1cn(COCC[Si](C)(C)C)c(-c2ccc(-c3ccc(OCC(C)(C)C(=O)OCc4ccccc4)cc3)nc2)n1

nearest known ligand 0.80

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 18/20 0.80
GABRA2 P47869 1/20 0.38
GABRB2 P47870 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
SCHEMBL18541104 0.90 DGAT1 (0.70) DGAT1
SCHEMBL16660753 0.89 DGAT1 (1.00) DGAT1GABRB2
SCHEMBL9936852 0.85 DGAT1 (1.00) DGAT1GABRA2GABRB2
SCHEMBL16660752 0.83 DGAT1 (0.71) DGAT1GABRA2GABRB2
SCHEMBL16787676 0.83 DGAT1 (0.73) DGAT1
SCHEMBL21064758 0.82 DGAT1 (1.00) DGAT1
SCHEMBL16787643 0.81 DGAT1 (0.89) DGAT1
SCHEMBL15293975 0.80 DGAT1 (0.77) DGAT1GABRA2GABRB2
SCHEMBL16787742 0.79 DGAT1 (0.77) DGAT1
SCHEMBL16660754 0.79 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 3 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
US-20170050950-A1 AROMATIC HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2017-02-23 US disclosed
US-20170050950-A1 AROMATIC HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2017-02-23 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 (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-10308636-B2 Aromatic heterocyclic compound GPR119, NR0B1, BET1 DGAT1 1688/4885GABRA2 1331/4885GABRB2 663/4885
US-20170050950-A1 AROMATIC HETEROCYCLIC COMPOUND GPR119, NR0B1, BET1 DGAT1 1688/4885GABRA2 1331/4885GABRB2 663/4885

“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.