SCHEMBL21943700

SCHEMBL21943700

CC(C)C(NC(=O)CCCCCNC(=O)CN1C(=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 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FAP Q12884 5/20 0.42
▸ SIRT2 Q8IXJ6 9/20 0.38
▸ SIRT1 Q96EB6 7/20 0.38
▸ SIRT3 Q9NTG7 3/20 0.37
▸ MAP1LC3B Q9GZQ8 2/20 0.37
▸ SIRT5 Q9NXA8 1/20 0.37
▸ NPY1R P25929 1/20 0.36
▸ NPY2R P49146 1/20 0.36
▸ NPY4R P50391 1/20 0.36
▸ NPY5R Q15761 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
SCHEMBL19502733 1.00 FAP (0.42) FAPSIRT2SIRT1SIRT3MAP1LC3B
SCHEMBL23420343 0.94 FAP (0.42) FAPSIRT2SIRT1SIRT3MAP1LC3B
SCHEMBL19708322 0.94 MAP1LC3B (0.40) FAPSIRT2SIRT1SIRT3MAP1LC3B
SCHEMBL18910972 0.94 MAP1LC3B (0.40) FAPSIRT2SIRT1SIRT3MAP1LC3B
SCHEMBL19046486 0.94 MAP1LC3B (0.40) FAPSIRT2SIRT1SIRT3MAP1LC3B
SCHEMBL22203014 0.94 MAP1LC3B (0.40) FAPSIRT2SIRT1SIRT3MAP1LC3B
SCHEMBL24068331 0.93 FAP (0.47) FAPSIRT2SIRT1SIRT3MAP1LC3B
SCHEMBL23268956 0.93 FAP (0.47) FAPSIRT2SIRT1SIRT3MAP1LC3B
SCHEMBL19708797 0.93 FAP (0.47) FAPSIRT2SIRT1SIRT3MAP1LC3B
SCHEMBL18823198 0.93 FAP (0.47) FAPSIRT2SIRT1SIRT3MAP1LC3B

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-20240199745-A1 ANTI-EGFR ANTIBODY DRUG CONJUGATES ABBVIE INC (US) 2024-06-20 — — US disclosed
US-20230135723-A1 ANTI-CD98 ANTIBODIES AND ANTIBODY DRUG CONJUGATES ABBVIE INC (US) 2023-05-04 — — US disclosed
US-20200113912-A1 Methods and Compositions for the Treatment of Disease with Immune Stimulatory Conjugates SILVERBACK THERAPEUTICS, INC. (US) 2020-04-16 — — 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 (3 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-20240199745-A1 ANTI-EGFR ANTIBODY DRUG CONJUGATES EGFR, ERBB2, ERBB3 FAP 4493/4885SIRT2 2594/4885SIRT1 3627/4885
US-20200113912-A1 Methods and Compositions for the Treatment of Disease with Immune Stimulatory Conjugates CD74, CD47, CD69 FAP 1948/4885SIRT2 4165/4885SIRT1 4429/4885
US-20230135723-A1 ANTI-CD98 ANTIBODIES AND ANTIBODY DRUG CONJUGATES CD99, SLC3A2, CD63 FAP 4580/4885SIRT2 3167/4885SIRT1 4723/4885

“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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