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Sugi Predict / Compounds / SCHEMBL31157965

SCHEMBL31157965

SCHEMBL31157965

CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ UTS2R Q9UKP6 1/20 0.58
▸ GHSR Q92847 4/20 0.57
▸ KISS1R Q969F8 1/20 0.57
▸ IL23R Q5VWK5 9/20 0.57
▸ NPY1R P25929 1/20 0.55
▸ NPY2R P49146 1/20 0.55
▸ NPY4R P50391 1/20 0.55

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
SCHEMBL29972966 0.96 IL23R (0.59) UTS2RGHSRKISS1RIL23R
SCHEMBL31619560 0.96 IL23R (0.59) UTS2RGHSRKISS1RIL23R
SCHEMBL31619561 0.96 IL23R (0.59) UTS2RGHSRKISS1RIL23R
SCHEMBL29404973 0.96 IL23R (0.60) UTS2RGHSRKISS1RIL23RNPY1R
SCHEMBL29414550 0.95 IL23R (0.61) UTS2RGHSRKISS1RIL23R
SCHEMBL31619565 0.95 IL23R (0.58) UTS2RGHSRKISS1RIL23R
SCHEMBL31619558 0.95 KISS1R (0.58) UTS2RGHSRKISS1RIL23R
SCHEMBL29404011 0.94 GHSR (0.60) GHSRKISS1RNPY1RNPY2RNPY4R
SCHEMBL31619556 0.94 IL23R (0.61) UTS2RGHSRKISS1RIL23R
SCHEMBL27481891 0.94 KISS1R (0.60) UTS2RGHSRKISS1RIL23RNPY1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114736286-B Synthesis method of polypeptide impurity monosulfide 江苏诺泰澳赛诺生物制药股份有限公司 2024-09-13 — — CN claimed
CN-114736286-B Synthesis method of polypeptide impurity monosulfide 江苏诺泰澳赛诺生物制药股份有限公司 2024-09-13 — — CN disclosed
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