SCHEMBL16787690

SCHEMBL16787690

COc1ccc(-c2cn(COCC[Si](C)(C)C)c(-c3ccc(-c4cnc(OCC(C)(C)C)cc4C)cc3Cl)n2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 16/20 1.00
DPP4 P27487 1/20 0.34
DPP8 Q6V1X1 1/20 0.34
DPP9 Q86TI2 1/20 0.34

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
SCHEMBL16790097 0.91 DGAT1 (0.84) DGAT1
SCHEMBL16787688 0.89 DGAT1 (0.80) DGAT1
SCHEMBL16660764 0.81 DGAT1 (0.67) DGAT1
SCHEMBL18541098 0.79 DGAT1 (0.65) DGAT1
SCHEMBL9936877 0.78 DGAT1 (0.64) DGAT1
SCHEMBL16787687 0.77 DGAT1 (0.62) DGAT1
SCHEMBL15282971 0.76 DGAT1 (0.62) DGAT1
SCHEMBL16661054 0.76 DGAT1 (0.60) DGAT1
SCHEMBL16661086 0.72 DGAT1 (0.56) DGAT1
SCHEMBL15282653 0.71 DGAT1 (0.55) 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-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 (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-20150158844-A1 AROMATIC HETEROCYCLIC COMPOUND GPR119, NR0B1, BET1 DGAT1 1688/4885DPP4 955/4885DPP8 1482/4885
US-20170050950-A1 AROMATIC HETEROCYCLIC COMPOUND GPR119, NR0B1, BET1 DGAT1 1688/4885DPP4 955/4885DPP8 1482/4885

“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.