SCHEMBL31140223

SCHEMBL31140223

C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TUBB4A P04350 2/20 0.56
▸ TUBB P07437 2/20 0.56
▸ TUBA3C P0DPH7 2/20 0.56
▸ TUBA1B P68363 2/20 0.56
▸ TUBA4A P68366 2/20 0.56
▸ TUBB4B P68371 2/20 0.56
▸ TUBB3 Q13509 2/20 0.56
▸ TUBB2A Q13885 2/20 0.56
▸ TUBB8 Q3ZCM7 2/20 0.56
▸ TUBA3E Q6PEY2 2/20 0.56
▸ TUBA1A Q71U36 2/20 0.56
▸ TUBA1C Q9BQE3 2/20 0.56
▸ TUBB6 Q9BUF5 2/20 0.56
▸ TUBB2B Q9BVA1 2/20 0.56
▸ TUBB1 Q9H4B7 2/20 0.56
▸ C5AR1 P21730 1/20 0.54
▸ GHSR Q92847 7/20 0.53
▸ GLP1R P43220 2/20 0.52
▸ NPBWR1 P48145 2/20 0.52
▸ IL23R Q5VWK5 1/20 0.51

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
SCHEMBL29517075 0.96 C5AR1 (0.54) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL29540710 0.94 C5AR1 (0.58) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL30550555 0.92 TUBB4A (0.55) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL29476447 0.92 MC4R (0.50) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL29476484 0.92 MC4R (0.50) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL30510360 0.92 C5AR1 (0.58) C5AR1GLP1RNPBWR1IL23RCXCR4
SCHEMBL30878115 0.91 GHSR (0.57) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL29973131 0.91 C5AR1 (0.55) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL29384877 0.91 C5AR1 (0.55) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL31016482 0.91 CTSL (0.54) TUBB4ATUBBTUBA3CTUBA1BTUBA4A

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-120152725-A Methods of treating obesity using MC4R agonists 节奏制药公司 2025-06-13 — — CN claimed
CN-120152725-A Methods of treating obesity using MC4R agonists 节奏制药公司 2025-06-13 — — CN disclosed
CN-119119190-A Melanocortin receptor ligands 益普生制药股份有限公司 2024-12-13 — — CN disclosed
CN-105837661-B Melanocortin receptor ligands 益普生制药股份有限公司 2024-10-15 — — CN disclosed
Send feedback