SCHEMBL29388680

SCHEMBL29388680

CC[C@H](C)[C@@H]1NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]3CSSC[C@H](NC1=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N3)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@H]1CSSC[C@H](NC(=O)[C@H](Cc3ccccc3)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H]([C@@H](C)O)NC1=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N2

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PLAU P00749 1/20 0.59
▸ ITGB3 P05106 1/20 0.55
▸ ITGB1 P05556 1/20 0.55
▸ ITGAV P06756 1/20 0.55
▸ ITGA5 P08648 1/20 0.55
▸ ITGB5 P18084 1/20 0.55
▸ CTSG P08311 1/20 0.54
▸ CACNA1B Q00975 1/20 0.53
▸ ST14 Q9Y5Y6 1/20 0.51
▸ KDM4A O75164 1/20 0.50
▸ ELANE P08246 4/20 0.50
▸ MC4R P32245 7/20 0.49
▸ MC5R P33032 7/20 0.49
▸ MC3R P41968 7/20 0.49
▸ MC1R Q01726 7/20 0.49
▸ NNMT P40261 1/20 0.49
▸ ERBB2 P04626 1/20 0.49

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
SCHEMBL29387473 0.95 ITGB3 (0.59) PLAUITGB3ITGB1ITGAVITGA5
SCHEMBL29420577 0.88 KLKB1 (0.50) PLAUITGB3ITGB1ITGAVITGA5
SCHEMBL29388360 0.83 ELANE (0.53) PLAUITGB3ITGB1ITGAVITGA5
SCHEMBL13722938 0.80 PLAU (0.50) PLAUITGB3ITGB1ITGAVITGA5
Cyclorgdfv SCHEMBL25474158 0.79 ITGB3 (0.58) ITGB3ITGB1ITGAVITGA5ITGB5
Cyclorgdfv SCHEMBL29973120 0.79 ITGB3 (0.58) ITGB3ITGB1ITGAVITGA5ITGB5
Cyclorgdfv SCHEMBL19605549 0.79 ITGB3 (0.58) ITGB3ITGB1ITGAVITGA5ITGB5
Cyclorgdfv SCHEMBL19605449 0.79 ITGB3 (0.58) ITGB3ITGB1ITGAVITGA5ITGB5
SCHEMBL25473422 0.79 KDM4A (0.55) ITGB3ITGB1ITGAVITGA5ITGB5
SCHEMBL27423920 0.78 MC4R (0.48) ITGB3ITGB1ITGAVITGA5ITGB5

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-119841964-A Multi-epitope vaccine antigen based on BCG and application thereof 新疆医科大学 2025-04-18 — — CN claimed
US-20250041381-A1 Prophylactic Uses of Theta Defensins UNIVERSITY OF SOUTHERN CALIFORNIA 2025-02-06 — — US claimed
EP-4426330-A1 PROPHYLACTIC USES OF THETA DEFENSINS THE UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2024-09-11 — — EP claimed
US-20230270828-A1 COMPOSITION FOR USE IN THE TREATMENT OF VIRAL INFECTIONS BICT S.R.L. (IT) 2023-08-31 — — US claimed
WO-2023081149-A1 PROPHYLACTIC USES OF THETA DEFENSINS THE UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2023-05-11 — — WO claimed
CN-122031654-A Targeting delivery nano-carrier antibacterial protein, preparation method and application thereof 海泰达生物科技(广州)有限公司 2026-05-15 — — CN disclosed
US-12569535-B2 Compositions and methods for enhancing systemic deliverability, tolerability, and efficacy of cationic macrocyclic peptides UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2026-03-10 — — US disclosed
EP-4643951-A2 ANTI-CD3 ANTIBODIES AND USES THEREOF Janssen Biotech, Inc. (US) 2025-11-05 — — EP disclosed
EP-3802608-B1 ANTI-CD3 ANTIBODIES AND USES THEREOF JANSSEN BIOTECH INC (US) 2025-04-30 — — EP disclosed
US-20250041381-A1 Prophylactic Uses of Theta Defensins UNIVERSITY OF SOUTHERN CALIFORNIA 2025-02-06 — — US disclosed
US-20240309049-A1 SYNTHETIC DNA BINDING DOMAIN PEPTIDES AND USES THEREOF THE UNIVERSITY OF CHICAGO (US) 2024-09-19 — — US disclosed
EP-4426330-A1 PROPHYLACTIC USES OF THETA DEFENSINS THE UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2024-09-11 — — EP disclosed
EP-4087555-A1 METHODS OF USING ANDROGRAPHOLIDE, ORIDONIN AND ISOLIQUIRITIGENIN AND DERIVATIVES THEREOF The Regents of The University of California (US) 2022-11-16 — — EP disclosed
EP-4087555-A1 METHODS OF USING ANDROGRAPHOLIDE, ORIDONIN AND ISOLIQUIRITIGENIN AND DERIVATIVES THEREOF The Regents of The University of California (US) 2022-11-16 — — EP disclosed
CN-109248310-B Blockade of inflammatory proteases using theta-defensins 加利福尼亚大学董事会 2022-07-01 — — CN disclosed
CN-108135947-B Materials and methods for enhancing immune response and skin and/or mucosal barrier function 群体创新有限责任公司 2022-06-14 — — CN disclosed
CN-114630818-A Protein-macromolecule conjugates and methods of use thereof 北京轩义医药科技有限公司 2022-06-14 — — CN disclosed
WO-2022104073-A1 DEFENSINS AS INHIBITORS OF SARS-COV-2 INFECTION AND USES THEREOF UNIVERSITY OF MARYLAND, BALTIMORE (US) 2022-05-19 — — WO disclosed
CN-114259441-A Composition for improving skin micro-ecological environment and preparation method and application thereof 科丝美诗(中国)化妆品有限公司 2022-04-01 — — CN disclosed
WO-2022029577-A1 COMPOSITION FOR USE IN THE TREATMENT OF VIRAL INFECTIONS BICT S.R.L. (IT) 2022-02-10 — — WO 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-20240309049-A1 SYNTHETIC DNA BINDING DOMAIN PEPTIDES AND USES THEREOF DDB1, SSBP1, CNBP PLAU 2596/4885ITGB3 4194/4885ITGB1 4592/4885
US-12569535-B2 Compositions and methods for enhancing systemic deliverability, tolerability, and efficacy of cationic macrocyclic peptides CFD, ARG1, IL1A PLAU 1170/4885ITGB3 1135/4885ITGB1 748/4885

“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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