SCHEMBL21064758

SCHEMBL21064758

COC(=O)C(C)(C)COc1ccc(-c2ccc(-c3nc(-c4cccc(C(=O)OCc5ccccc5)c4)cn3COCC[Si](C)(C)C)cn2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 19/20 1.00
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL16787643 0.94 DGAT1 (0.89) DGAT1KDM4ENPC1ALDH1A1RAB9A
SCHEMBL16790121 0.90 DGAT1 (0.82) DGAT1
SCHEMBL16790124 0.90 DGAT1 (0.82) DGAT1
SCHEMBL16790122 0.88 DGAT1 (0.79) DGAT1
SCHEMBL16790123 0.85 DGAT1 (0.73) DGAT1
SCHEMBL16787676 0.84 DGAT1 (0.73) DGAT1
SCHEMBL16787655 0.84 DGAT1 (0.72) DGAT1
SCHEMBL18552871 0.83 DGAT1 (0.71) DGAT1
SCHEMBL18541103 0.82 DGAT1 (0.80) DGAT1
SCHEMBL16787654 0.82 DGAT1 (0.69) 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 1 patent. 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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 1688/4885KDM4E 1080/4885NPC1 796/4885

“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.