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SCHEMBL29556709

SCHEMBL29556709

N=C(N)NCCC[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ C5AR1 P21730 1/20 0.61
▸ OPRD1 P41143 9/20 0.59
▸ OPRM1 P35372 7/20 0.59
▸ KISS1R Q969F8 1/20 0.58
▸ IL23R Q5VWK5 1/20 0.56
▸ MC4R P32245 1/20 0.56
▸ MC5R P33032 1/20 0.56
▸ MC3R P41968 1/20 0.56
▸ MC1R Q01726 1/20 0.56
▸ CCKBR P32239 1/20 0.56

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
SCHEMBL29555997 0.98 C5AR1 (0.60) C5AR1OPRD1OPRM1KISS1RIL23R
SCHEMBL30518167 0.92 C5AR1 (0.69) C5AR1OPRD1OPRM1IL23RMC4R
SCHEMBL31300431 0.91 CCKBR (0.58) C5AR1KISS1RIL23RMC4RMC5R
SCHEMBL31612389 0.90 C5AR1 (0.55) C5AR1OPRD1OPRM1KISS1R
SCHEMBL30566365 0.90 CXCR4 (0.58) C5AR1OPRD1OPRM1MC4RMC5R
SCHEMBL29500468 0.89 C5AR1 (0.59) C5AR1OPRM1KISS1RCCKBR
SCHEMBL5167427 0.88 KISS1R (0.67) KISS1R
SCHEMBL5167437 0.88 KISS1R (0.67) KISS1R
SCHEMBL30566367 0.87 CXCR4 (0.59) C5AR1MC4RMC5RMC3RMC1R
SCHEMBL30571131 0.87 C5AR1 (0.59) C5AR1OPRM1KISS1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114315965-B Anti-obesity peptides and uses thereof 华南理工大学 2023-05-12 — — CN claimed
CN-114315965-A Anti-obesity peptides and uses thereof 华南理工大学 2022-04-12 — — CN claimed
CN-114315965-B Anti-obesity peptides and uses thereof 华南理工大学 2023-05-12 — — CN disclosed
CN-114315965-A Anti-obesity peptides and uses thereof 华南理工大学 2022-04-12 — — CN disclosed