SCHEMBL19687790

SCHEMBL19687790

CC(C)C(C)C(=O)OCc1ccc(NC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](NC(=O)CCOCCN)C(C)C)cc1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SIRT5 Q9NXA8 3/20 0.39
▸ SIRT2 Q8IXJ6 8/20 0.39
▸ SIRT1 Q96EB6 7/20 0.39
▸ SIRT3 Q9NTG7 3/20 0.39
▸ CHRNA1 P02708 1/20 0.38
▸ CHRNG P07510 1/20 0.38
▸ CHRNB1 P11230 1/20 0.38
▸ CHRND Q07001 1/20 0.38
▸ MAP1LC3B Q9GZQ8 2/20 0.38
▸ FURIN P09958 2/20 0.38
▸ HTT P42858 1/20 0.38
▸ MMP3 P08254 1/20 0.36

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
SCHEMBL15699830 0.94 SIRT5 (0.39) SIRT5SIRT2SIRT1SIRT3CHRNA1
SCHEMBL19387330 0.92 SIRT5 (0.38) SIRT5SIRT2SIRT1SIRT3CHRNA1
SCHEMBL24296990 0.91 FURIN (0.40) SIRT2SIRT1SIRT3CHRNA1CHRNG
SCHEMBL23051312 0.91 MAP1LC3B (0.38) SIRT5SIRT2SIRT1SIRT3CHRNA1
SCHEMBL27277396 0.90 SIRT5 (0.40) SIRT5SIRT2SIRT1SIRT3MAP1LC3B
SCHEMBL25000070 0.90 SIRT2 (0.38) SIRT5SIRT2SIRT1SIRT3CHRNA1
SCHEMBL22138594 0.90 FURIN (0.39) CHRNA1CHRNGCHRNB1CHRNDFURIN
SCHEMBL22138596 0.90 FURIN (0.39) CHRNA1CHRNGCHRNB1CHRNDFURIN
SCHEMBL20705515 0.90 FURIN (0.39) CHRNA1CHRNGCHRNB1CHRNDFURIN
SCHEMBL27447192 0.90 FURIN (0.39) CHRNA1CHRNGCHRNB1CHRNDFURIN

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-10603386-B2 Protein-polymer-drug conjugates MERSANA THERAPEUTICS, INC. (US) 2020-03-31 — — US disclosed
US-20170348424-A1 PROTEIN-POLYMER-DRUG CONJUGATES MERSANA THERAPEUTICS, INC. 2017-12-07 — — 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-20170348424-A1 PROTEIN-POLYMER-DRUG CONJUGATES PBRM1, CLTB, BRAP SIRT5 2776/4885SIRT2 2534/4885SIRT1 2369/4885
US-10603386-B2 Protein-polymer-drug conjugates PBRM1, CLTB, BRAP SIRT5 2022/4885SIRT2 2262/4885SIRT1 2098/4885

“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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