SCHEMBL3453396

SCHEMBL3453396

C[Si](C)(C)CCOCn1ccc2c(-c3cnc(C=O)o3)ncnc21

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.31

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
SCHEMBL100120 0.79 CYP3A4 (0.36) DGAT1
SCHEMBL99015 0.78 DGAT1 (0.34) DGAT1
SCHEMBL18975759 0.76 TPH1 (0.33) DGAT1
SCHEMBL29710434 0.76 TPH1 (0.41) DGAT1
SCHEMBL30446012 0.76 TPH1 (0.41) DGAT1
SCHEMBL30445095 0.75 SIGMAR1 (0.38) DGAT1
SCHEMBL30445481 0.75 SIGMAR1 (0.36) DGAT1
SCHEMBL100799 0.75 DGAT1 (0.35) DGAT1
SCHEMBL99142 0.74 SIGMAR1 (0.40) DGAT1
SCHEMBL31089960 0.74 SIGMAR1 (0.40) 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-20100022522-A1 HETEROARYL SUBSTITUTED PYRROLO[2,3-b]PYRIDINES AND PYRROLO[2,3-b]PYRIMIDINES AS JANUS KINASE INHIBITORS Incyte Corporationn, a Delaware corporation 2010-01-28 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-20100022522-A1 HETEROARYL SUBSTITUTED PYRROLO[2,3-b]PYRIDINES AND PYRROLO[2,3-b]PYRIMIDINES AS JANUS KINASE INHIBITORS JAK3, JAK1, JAK2 DGAT1 4526/4885

“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.