SCHEMBL30051514

SCHEMBL30051514

CC(C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 3/20 0.57
▸ CALCRL Q16602 1/20 0.52
▸ LMNA P02545 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ REN P00797 2/20 0.49
▸ BACE1 P56817 1/20 0.49
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ ATM Q13315 1/20 0.47
▸ MME P08473 3/20 0.46
▸ ACE P12821 2/20 0.46
▸ CPA1 P15085 2/20 0.46
▸ ACE2 Q9BYF1 2/20 0.46

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
SCHEMBL9642398 0.93 CALCRL (0.56) CTSCCALCRLRENBACE1KMT2A
SCHEMBL18568248 0.93 CALCRL (0.56) CTSCCALCRLRENBACE1KMT2A
SCHEMBL8953885 0.93 CALCRL (0.56) CTSCCALCRLRENBACE1KMT2A
SCHEMBL30123252 0.93 CTSC (0.59) CTSCCALCRLLMNATDP1REN
SCHEMBL29433973 0.92 CALCRL (0.56) CTSCCALCRLRENBACE1
SCHEMBL30239995 0.92 CTSC (0.52) CTSCCALCRLLMNATDP1REN
SCHEMBL30240006 0.92 CTSC (0.48) CTSCCALCRLBACE1MMEACE
SCHEMBL30051852 0.91 REN (0.58) CTSCLMNATDP1RENMME
SCHEMBL30051563 0.89 CTSC (0.59) CTSCCALCRLLMNATDP1REN
SCHEMBL29695560 0.88 CTSC (0.58) CTSCCALCRLLMNATDP1REN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12622975-B2 Peptide-conjugated prodrugs BRANDEIS UNIVERSITY (US) 2026-05-12 — — US disclosed
US-20250339504-A1 CANCER VACCINE WITH USE OF COMMON CANCER ANTIGEN COCKTAIL, TCR/CAR-T CELL THERAPEUTIC, COMPANION DIAGNOSTIC METHOD, AND METHOD FOR DIAGNOSING RISK OF CANCER ONSET BY DETECTING CIRCULATING TUMOR CELLS NATIONAL CANCER CENTER (JP) 2025-11-06 — — US disclosed
US-20230151057-A1 LACTIC ACID BACTERIA GROWTH PROMOTER ASAHI GROUP HOLDINGS, LTD. (JP) 2023-05-18 — — US disclosed
EP-4159742-A1 LACTIC ACID BACTERIA GROWTH PROMOTER Asahi Group Holdings, Ltd. (JP) 2023-04-05 — — EP disclosed
US-20220387610-A1 PEPTIDE-CONJUGATED PRODRUGS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-12-08 — — 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-12622975-B2 Peptide-conjugated prodrugs PEPD, PAM, VIP CTSC 131/4885CALCRL 1193/4885LMNA 1538/4885
US-20220387610-A1 PEPTIDE-CONJUGATED PRODRUGS VIP, DNPEP, PEPD CTSC 37/4885CALCRL 219/4885LMNA 3184/4885

“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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