SCHEMBL22668397

SCHEMBL22668397

CSC(C)(C)C(=O)OCc1ccc(NC(=O)[C@@H](CCCNC(N)=O)NC(=O)[C@H](NC(=O)CCCCNC(=O)CI)C(C)C)cc1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 8/20 0.39
▸ SIRT1 Q96EB6 7/20 0.39
▸ SIRT5 Q9NXA8 3/20 0.38
▸ SIRT3 Q9NTG7 3/20 0.37
▸ HTT P42858 1/20 0.36
▸ MAP1LC3B Q9GZQ8 2/20 0.36
▸ NPY1R P25929 1/20 0.35
▸ NPY2R P49146 1/20 0.35
▸ NPY4R P50391 1/20 0.35
▸ NPY5R Q15761 1/20 0.35
▸ FURIN P09958 2/20 0.35
▸ FAP Q12884 1/20 0.35

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
SCHEMBL21013509 1.00 SIRT2 (0.39) SIRT2SIRT1SIRT5SIRT3HTT
SCHEMBL20467874 0.93 SIRT2 (0.41) SIRT2SIRT1SIRT5SIRT3HTT
SCHEMBL18908995 0.93 SIRT2 (0.41) SIRT2SIRT1SIRT5SIRT3HTT
SCHEMBL21568762 0.93 SIRT2 (0.41) SIRT2SIRT1SIRT5SIRT3HTT
SCHEMBL19046262 0.93 SIRT2 (0.41) SIRT2SIRT1SIRT5SIRT3HTT
SCHEMBL23789221 0.93 SIRT2 (0.41) SIRT2SIRT1SIRT5SIRT3HTT
SCHEMBL21018739 0.92 SIRT2 (0.40) SIRT2SIRT1SIRT5SIRT3HTT
SCHEMBL19681469 0.92 SIRT2 (0.40) SIRT2SIRT1SIRT5SIRT3HTT
SCHEMBL24335319 0.91 SIRT2 (0.42) SIRT2SIRT1SIRT5SIRT3HTT
SCHEMBL22698585 0.90 SIRT2 (0.41) SIRT2SIRT1SIRT5SIRT3HTT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210139585-A1 CD19 BINDING MOLECULES AND USES THEREOF NOVARTIS AG (CH) 2021-05-13 — — US disclosed
US-20200362054-A1 TRISPECIFIC BINDING MOLECULES AGAINST TUMOR-ASSOCIATED ANTIGENTS AND USE THEREOF NOVARTIS AG (CH) 2020-11-19 — — 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-20210139585-A1 CD19 BINDING MOLECULES AND USES THEREOF CD22, BCL9, CD2 SIRT2 4848/4885SIRT1 4822/4885SIRT5 4536/4885
US-20200362054-A1 TRISPECIFIC BINDING MOLECULES AGAINST TUMOR-ASSOCIATED ANTIGENTS AND USE THEREOF CD2, CD2BP2, CD22 SIRT2 4865/4885SIRT1 4876/4885SIRT5 4790/4885

“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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