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Sugi Predict / Compounds / SCHEMBL28940915

SCHEMBL28940915

SCHEMBL28940915

CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(N)=O

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 6/20 0.71
▸ IL23R Q5VWK5 3/20 0.59
▸ GHSR Q92847 9/20 0.59

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
SCHEMBL23483109 1.00 MC4R (0.71) MC4RIL23RGHSR
SCHEMBL23152931 1.00 MC4R (0.71) MC4RIL23RGHSR
SCHEMBL23484389 0.99 MC4R (0.69) MC4RIL23RGHSR
SCHEMBL14511692 0.94 MC4R (0.71) MC4RIL23RGHSR
SCHEMBL14511696 0.91 MC4R (0.67) MC4RIL23RGHSR
SCHEMBL20108277 0.89 MC4R (0.61) MC4RIL23RGHSR
SCHEMBL23430098 0.89 MC4R (0.59) MC4RGHSR
SCHEMBL30924749 0.89 KISS1R (0.62) MC4RIL23R
SCHEMBL30014698 0.89 MC4R (0.56) MC4RIL23R
SCHEMBL28940921 0.89 MC4R (0.56) MC4RIL23R

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
CN-115884790-A Therapeutic combinations of drugs and methods of use thereof 康圣博施医药有限公司 2023-03-31 — — CN claimed
CN-115884790-A Therapeutic combinations of drugs and methods of use thereof 康圣博施医药有限公司 2023-03-31 — — CN disclosed
CN-115590966-A Therapeutic combinations of drugs and methods of use thereof 康圣博施医药有限公司（US） 2023-01-13 — — CN disclosed
CN-115350184-A Therapeutic combinations of drugs and methods of use thereof 康圣博施医药有限公司 2022-11-18 — — CN disclosed
CN-115304595-A Therapeutic combinations of drugs and methods of use thereof 康圣博施医药有限公司 2022-11-08 — — CN disclosed
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