SCHEMBL18823482

SCHEMBL18823482

CC(C)C(NC(=O)CCCCN1C(=O)C=CC1=O)C(=O)N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(COC(=O)C(C)(C)C)cc1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FAP Q12884 5/20 0.46
▸ MAP1LC3B Q9GZQ8 2/20 0.38
▸ SIRT5 Q9NXA8 1/20 0.36
▸ SIRT2 Q8IXJ6 8/20 0.36
▸ SIRT1 Q96EB6 7/20 0.36
▸ SIRT3 Q9NTG7 3/20 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 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
SCHEMBL19750495 1.00 FAP (0.46) FAPMAP1LC3BSIRT5SIRT2SIRT1
SCHEMBL19387405 1.00 FAP (0.46) FAPMAP1LC3BSIRT5SIRT2SIRT1
SCHEMBL23268956 0.99 FAP (0.47) FAPMAP1LC3BSIRT5SIRT2SIRT1
SCHEMBL18823198 0.99 FAP (0.47) FAPMAP1LC3BSIRT5SIRT2SIRT1
SCHEMBL18823197 0.99 FAP (0.47) FAPMAP1LC3BSIRT5SIRT2SIRT1
SCHEMBL24068331 0.99 FAP (0.47) FAPMAP1LC3BSIRT5SIRT2SIRT1
SCHEMBL18909001 0.99 FAP (0.47) FAPMAP1LC3BSIRT5SIRT2SIRT1
SCHEMBL19708797 0.99 FAP (0.47) FAPMAP1LC3BSIRT5SIRT2SIRT1
SCHEMBL20340686 0.97 FAP (0.46) FAPMAP1LC3BSIRT5SIRT2SIRT1
SCHEMBL18908999 0.96 FAP (0.43) FAPMAP1LC3BSIRT5SIRT2SIRT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9872918-B2 Hydroxyl-polymer-drug-protein conjugates MERSANA THERAPEUTICS, INC. (US) 2018-01-23 — — US disclosed
US-9770519-B2 Protein-polymer-drug conjugates MERSANA THERAPEUTICS, INC. (US) 2017-09-26 — — US disclosed
US-20170119896-A1 TERMINALLY MODIFIED POLYMERS AND CONJUGATES THEREOF MERSANA THERAPEUTICS, INC. 2017-05-04 — — 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-20170119896-A1 TERMINALLY MODIFIED POLYMERS AND CONJUGATES THEREOF MALT1, ALG1, PRMT3 FAP 4017/4885MAP1LC3B 727/4885SIRT5 2673/4885

“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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