SCHEMBL23387035

SCHEMBL23387035

CC(S)c1cn(CCCC[C@H](NC(=O)N[C@H](CCC(=O)O)C(=O)O)C(=O)O)nn1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 12/20 0.67
▸ FOLH1 Q04609 8/20 0.64

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
SCHEMBL25897923 0.83 DGAT1 (0.79) DGAT1FOLH1
SCHEMBL22957840 0.83 DGAT1 (0.79) DGAT1FOLH1
SCHEMBL23386738 0.82 DGAT1 (0.68) DGAT1FOLH1
SCHEMBL563615 0.80 DGAT1 (1.00) DGAT1FOLH1
SCHEMBL563614 0.80 DGAT1 (1.00) DGAT1FOLH1
SCHEMBL22712914 0.78 FOLH1 (1.00) DGAT1FOLH1
SCHEMBL18161528 0.78 FOLH1 (1.00) DGAT1FOLH1
SCHEMBL14722195 0.78 FOLH1 (1.00) DGAT1FOLH1
SCHEMBL14722192 0.78 FOLH1 (1.00) DGAT1FOLH1
SCHEMBL20979154 0.77 FOLH1 (0.75) DGAT1FOLH1

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-20210145974-A1 Bifunctional Small Molecules to Target the Selective Degradation of Circulating Proteins YALE UNIVERSITY 2021-05-20 — — 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-20210145974-A1 Bifunctional Small Molecules to Target the Selective Degradation of Circulating Proteins ASGR1, LDLR, FCGR3B DGAT1 3033/4885FOLH1 1190/4885

“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.

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