SCHEMBL29557006

SCHEMBL29557006

CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C(C)(C)N)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 14/20 0.41
▸ SCTR P47872 1/20 0.41
▸ SLC15A2 Q16348 1/20 0.38
▸ FOLH1 Q04609 1/20 0.37

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
SCHEMBL29557539 0.92 GLP1R (0.40) GLP1RSCTRSLC15A2FOLH1
SCHEMBL29478145 0.91 SLC15A2 (0.40) GLP1RSCTRSLC15A2FOLH1
SCHEMBL29557424 0.90 SLC15A2 (0.43) GLP1RSCTRSLC15A2FOLH1
SCHEMBL29557080 0.88 BACE1 (0.40) GLP1RSCTR
SCHEMBL31265393 0.88 SLC15A2 (0.45) GLP1RSCTRSLC15A2FOLH1
SCHEMBL29557273 0.87 GLP1R (0.41) GLP1RSCTR
SCHEMBL31265386 0.87 SLC15A2 (0.45) GLP1RSCTRSLC15A2FOLH1
SCHEMBL29381521 0.86 BACE1 (0.40) GLP1RSCTRSLC15A2FOLH1
SCHEMBL31265383 0.86 SLC15A2 (0.46) GLP1RSCTRSLC15A2
SCHEMBL30974298 0.86 FOLH1 (0.42) GLP1RSCTRSLC15A2FOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114945579-B Heme derivative and preparation method and application thereof 吉林省澳宇生物科技有限公司 2025-01-21 — — CN disclosed
CN-114945579-A Heme derivatives, their preparation and use 吉林省澳宇生物科技有限公司 2022-08-26 — — CN disclosed
CN-114053398-A New medicinal application of heme polypeptide derivative 吉林省澳宇生物科技有限公司 2022-02-18 — — CN disclosed
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