SCHEMBL29533628

SCHEMBL29533628

O=C(O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ITGB2 P05107 5/20 0.67
▸ ICAM1 P05362 5/20 0.67
▸ ITGAL P20701 5/20 0.67
▸ GHSR Q92847 1/20 0.61
▸ ALOX15 P16050 1/20 0.58
▸ ACE P12821 3/20 0.57
▸ ERAP2 Q6P179 1/20 0.56
▸ ECE1 P42892 3/20 0.53
▸ FPR2 P25090 1/20 0.53

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
SCHEMBL29144196 1.00 ITGB2 (0.67) ITGB2ICAM1ITGALGHSRALOX15
SCHEMBL21641802 1.00 ITGB2 (0.67) ITGB2ICAM1ITGALGHSRALOX15
SCHEMBL29904257 1.00 ITGB2 (0.67) ITGB2ICAM1ITGALGHSRALOX15
SCHEMBL21641801 1.00 ITGB2 (0.67) ITGB2ICAM1ITGALGHSRALOX15
SCHEMBL31606450 0.97 ITGB2 (0.68) ITGB2ICAM1ITGALGHSRALOX15
SCHEMBL29533411 0.96 GHSR (0.65) ITGB2ICAM1ITGALGHSRACE
SCHEMBL31609182 0.92 GHSR (0.63) ITGB2ICAM1ITGALGHSRACE
SCHEMBL29550930 0.92 GHSR (0.63) ITGB2ICAM1ITGALGHSRACE
SCHEMBL30051684 0.92 GHSR (0.63) ITGB2ICAM1ITGALGHSRACE
SCHEMBL30052886 0.92 GHSR (0.63) ITGB2ICAM1ITGALGHSRACE

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119339933-A Age estimation method based on multidimensional data 中国科学院北京基因组研究所(国家生物信息中心) 2025-01-21 — — CN claimed
CN-119015834-A Carbon dioxide separation membrane and preparation method thereof 国家能源投资集团有限责任公司 2024-11-26 — — CN claimed
US-20240315296-A1 PEPTIDE COMPOUNDS FOR FLAVOR MODULATING CJ CHEILJEDANG CORPORATION (KR) 2024-09-26 — — US claimed
EP-4364582-A1 PEPTIDE COMPOUNDS FOR FLAVOR MODULATING CJ Cheiljedang Corporation (KR) 2024-05-08 — — EP claimed
WO-2023277549-A1 PEPTIDE COMPOUNDS FOR FLAVOR MODULATING 씨제이제일제당 (주) 2023-01-05 — — WO claimed
CN-114380889-A Humanized ACE2 polypeptide retarder as well as design and synthesis method and application thereof 中国科学院大连化学物理研究所 2022-04-22 — — CN claimed
US-12622975-B2 Peptide-conjugated prodrugs BRANDEIS UNIVERSITY (US) 2026-05-12 — — US disclosed
CN-120983601-A Application of cyclic dipeptide in preparation of medicines for treating diseases related to damage of calcium sensitive receptor 中国人民解放军陆军军医大学第二附属医院 2025-11-21 — — CN disclosed
EP-4613260-A1 COMPOUNDS AND COSMETIC, DERMOCOSMETIC, COSMECEUTICAL OR PHARMACEUTICAL COMPOSITIONS FOR RELAXING MUSCLES, INCLUDING THE SKELETAL MUSCLES OF THE FACE, FOR ANTI-AGING COSMETIC ACTION, FOR REDUCING AND/OR SMOOTHING EXPRESSION LINES AND WRINKLES AND/OR FOR ANTIPERSPIRANT ACTION, USES AND METHODS Chemyunion Ltda (BR) 2025-09-10 — — EP disclosed
WO-2025109003-A1 P-CADHERIN LIGANDS 3B PHARMACEUTICALS GMBH (DE) 2025-05-30 — — WO disclosed
EP-4554615-A1 PERSONALIZED LONGITUDINAL ANALYSIS OF CIRCULATING MATERIAL TO MONITOR AND ADAPT NEOANTIGEN CANCER VACCINES Amazon Technologies, Inc. (US) 2025-05-21 — — EP disclosed
CN-119546333-A Personalized longitudinal analysis of circulating material to monitor and modulate neoantigen cancer vaccines 亚马逊科技公司 2025-02-28 — — CN disclosed
CN-119339933-A Age estimation method based on multidimensional data 中国科学院北京基因组研究所(国家生物信息中心) 2025-01-21 — — CN disclosed
CN-117210441-A Low-temperature salt-tolerant beta-glucosidase and application thereof in conversion of ginsenoside Rb1 云南师范大学 2023-12-12 — — CN disclosed
CN-114380889-B Humanized ACE2 polypeptide blocker and design and synthesis method and application thereof 中国科学院大连化学物理研究所 2023-11-17 — — CN disclosed
WO-2023277549-A1 PEPTIDE COMPOUNDS FOR FLAVOR MODULATING 씨제이제일제당 (주) 2023-01-05 — — WO 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
US-20220370570-A1 TREATMENT/PREVENTION OF DISEASE BY LINC COMPLEX INHIBITION NATIONAL UNIVERSITY OF SINGAPORE (SG) 2022-11-24 — — US disclosed
US-11331368-B2 Angiotensin receptor agonists and uses thereof MONASH UNIVERSITY (AU) 2022-05-17 — — US disclosed
CN-114380889-A Humanized ACE2 polypeptide retarder as well as design and synthesis method and application thereof 中国科学院大连化学物理研究所 2022-04-22 — — CN 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 ITGB2 3494/4885ICAM1 2949/4885ITGAL 2468/4885
US-20220387610-A1 PEPTIDE-CONJUGATED PRODRUGS VIP, DNPEP, PEPD ITGB2 3719/4885ICAM1 2371/4885ITGAL 2907/4885

“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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