SCHEMBL29462886

SCHEMBL29462886

CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O)C(C)C

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 2/20 0.68
▸ MC5R P33032 2/20 0.68
▸ MC3R P41968 2/20 0.68
▸ MC1R Q01726 2/20 0.68
▸ IL23R Q5VWK5 1/20 0.66
▸ C5AR1 P21730 1/20 0.64
▸ CXCR4 P61073 4/20 0.63
▸ GLP1R P43220 5/20 0.62
▸ CXCL8 P10145 5/20 0.61
▸ GCGR P47871 3/20 0.60

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
SCHEMBL29361885 0.96 GLP1R (0.66) MC4RMC5RMC3RMC1RIL23R
SCHEMBL31332244 0.95 CXCL8 (0.64) MC4RMC5RMC3RMC1RIL23R
SCHEMBL29397826 0.95 CXCL8 (0.64) MC4RMC5RMC3RMC1RIL23R
SCHEMBL29389654 0.93 MC4R (0.67) MC4RMC5RMC3RMC1RIL23R
SCHEMBL29874649 0.91 MC4R (0.69) MC4RMC5RMC3RMC1RIL23R
SCHEMBL18388638 0.88 C5AR1 (0.74) MC4RMC5RMC3RMC1RC5AR1
SCHEMBL31477752 0.88 MC4R (0.83) MC4RMC5RMC3RMC1RC5AR1
SCHEMBL30495708 0.88 CXCR4 (0.71) CXCR4GLP1RCXCL8GCGR
SCHEMBL29581575 0.87 MC4R (0.60) MC4RMC5RMC3RMC1RIL23R
Dynorphin A (1-17) SCHEMBL31331988 0.87 NPY1R (0.68) IL23RC5AR1CXCR4GLP1R

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-109022310-B Bacillus Bam22 for improving resistance and growth of ryegrass and use method thereof 四川省农业科学院植物保护研究所 2022-03-22 — — CN claimed
US-12338464-B2 Clonal strains of attenuated vaccinia viruses and methods of use thereof GENELUX CORPORATION (US) 2025-06-24 — — US disclosed
WO-2025106999-A1 DEPRIVATION OF HUMAN PLURIPOTENT STEM CELL-DERIVED TRPV1+, MRGPRX1+ AND SCN9A+ SENSORY NEURONS AND THEIR FUNCTIONAL CHARACTERIZATION THE JOHNS HOPKINS UNIVERSITY (US) 2025-05-22 — — WO disclosed
US-20250001013-A1 MODULATORS OF ADENO-ASSOCIATED VIRUS TRANSDUCTION AND USES THEREOF NOVARTIS AG (CH) 2025-01-02 — — US disclosed
EP-4436982-A1 MODULATORS OF ADENO-ASSOCIATED VIRUS TRANSDUCTION AND USES THEREOF Novartis AG (CH) 2024-10-02 — — EP disclosed
CN-118632860-A Adeno-associated virus transduction modulators and uses thereof 诺华股份有限公司 2024-09-10 — — CN disclosed
EP-3962510-B1 NOVEL SELECTIVE ACKR3 MODULATORS AND USES THEREOF LUXEMBOURG INST OF HEALTH LIH (LU) 2024-08-28 — — EP disclosed
CN-114601912-B Itching-causing polypeptide for biting of ticks and mosquitoes and application of itching-causing polypeptide in resisting itching 武汉大学 2024-08-02 — — CN disclosed
CN-116491524-B Application and method for controlling mulberry sclerotinia by using coniothyrium minitans 四川省农业科学院植物保护研究所 2024-07-05 — — CN disclosed
EP-3743422-B1 CRYSTALLINE FORMS OF THE CXCR7 RECEPTOR ANTAGONIST (3S,4S)-1-CYCLOPROPYLMETHYL-4-{[5-(2,4-DIFLUORO-PHENYL)-ISOXAZOLE-3-CARBONYL]-AMINO}-PIPERIDINE-3-CARBOXYLIC ACID (1-PYRIMIDIN-2-YL-CYCLOPROPYL)-AMIDE IDORSIA PHARMACEUTICALS LTD (CH) 2024-03-13 — — EP disclosed
US-20220236279-A1 Novel Selective ACKR3 Modulators and Uses Thereof LUXEMBOURG INSTITUTE OF HEALTH (LIH) (LU) 2022-07-28 — — US disclosed
WO-2022136486-A1 CONOLIDINE ANALOGUES AS SELECTIVE ACKR3 MODULATORS FOR THE TREATMENT OF CANCER AND CARDIOVASCULAR DISEASES LUXEMBOURG INSTITUTE OF HEALTH (LIH) (LU) 2022-06-30 — — WO disclosed
CN-114601912-A Itch-caused polypeptide caused by tick and mosquito bites and itch-resisting application thereof 武汉大学 2022-06-10 — — CN disclosed
US-11339148-B2 Crystalline forms of the CXCR7 receptor antagonist (3S,4S)-1-Cyclopropylmethyl-4-{[5-(2,4-difluoro-phenyl)-isoxazole-3-carbonyl]-amino}-piperidine-3-carboxylic acid (1-pyrimidin-2-yl-cyclopropyl)-amide IDORSIA PHARMACEUTICALS LTD. (CH) 2022-05-24 — — US disclosed
US-11306078-B2 Piperidine CXCR7 receptor modulators IDORSIA PHARMACEUTICALS LTD. (CH) 2022-04-19 — — US disclosed
CN-114262690-A Clonal strains of attenuated vaccinia virus and methods of use thereof 吉恩勒克斯公司 2022-04-01 — — CN disclosed
CN-109022310-B Bacillus Bam22 for improving resistance and growth of ryegrass and use method thereof 四川省农业科学院植物保护研究所 2022-03-22 — — CN disclosed
CN-109022310-B Bacillus Bam22 for improving resistance and growth of ryegrass and use method thereof 四川省农业科学院植物保护研究所 2022-03-22 — — CN disclosed
CN-109022310-B Bacillus Bam22 for improving resistance and growth of ryegrass and use method thereof 四川省农业科学院植物保护研究所 2022-03-22 — — CN disclosed
EP-3962510-A1 NOVEL SELECTIVE ACKR3 MODULATORS AND USES THEREOF Luxembourg Institute Of Health (LIH) (LU) 2022-03-09 — — EP 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-11306078-B2 Piperidine CXCR7 receptor modulators CXCR1, CXCR5, ACKR3 MC4R 600/4885MC5R 432/4885MC3R 416/4885
US-11339148-B2 Crystalline forms of the CXCR7 receptor antagonist (3S,4S)-1-Cyclopropylmethyl-4-{[5-(2,4-difluoro-phenyl)-isoxazole-3-carbonyl]-amino}-piperidine-3-carboxylic acid (1-pyrimidin-2-yl-cyclopropyl)-amide CXCR1, CXCR5, CXCR4 MC4R 423/4885MC5R 228/4885MC3R 195/4885

“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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