SCHEMBL30311313

SCHEMBL30311313

CC(C)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 1/20 0.47
▸ TFPI P10646 1/20 0.46
▸ CALCRL Q16602 1/20 0.46
▸ KDM1A O60341 3/20 0.45
▸ GRPR P30550 1/20 0.45
▸ RXFP1 Q9HBX9 1/20 0.45
▸ CTSD P07339 1/20 0.45
▸ BACE1 P56817 1/20 0.45
▸ MAOB P27338 1/20 0.44
▸ KDM5A P29375 1/20 0.44
▸ KDM1B Q8NB78 1/20 0.44
▸ BCL2L1 Q07817 1/20 0.44
▸ PTH1R Q03431 2/20 0.43
▸ BECN1 Q14457 1/20 0.43
▸ VIPR1 P32241 2/20 0.42
▸ VIPR2 P41587 2/20 0.42
▸ NPY1R P25929 2/20 0.42
▸ NPY2R P49146 2/20 0.42
▸ NPY4R P50391 2/20 0.42
▸ NPY5R Q15761 2/20 0.42

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
Acetic Acid SCHEMBL30311237 0.99 KEAP1 (0.46) KEAP1TFPICALCRLKDM1AGRPR
SCHEMBL30311449 0.94 BACE1 (0.47) KEAP1CALCRLKDM1ACTSDBACE1
SCHEMBL30311211 0.92 KDM1A (0.55) KEAP1TFPIKDM1AMAOBKDM5A
SCHEMBL30311294 0.91 KDM1A (0.54) KEAP1TFPIKDM1AMAOBKDM5A
Acetic Acid SCHEMBL30311272 0.91 KDM1A (0.54) KEAP1TFPIKDM1AMAOBKDM5A
Acetic Acid SCHEMBL30311135 0.90 KDM1A (0.53) KEAP1TFPIKDM1AMAOBKDM5A
SCHEMBL30311231 0.89 KDM1A (0.50) KEAP1CALCRLKDM1ACTSDBACE1
SCHEMBL30427492 0.87 CALCRL (0.45) KEAP1CALCRLGRPRBCL2L1VIPR1
SCHEMBL29568802 0.87 KDM1A (0.45) KDM1ACTSDBACE1MAOBKDM5A
SCHEMBL30311365 0.86 BACE1 (0.42) KEAP1CALCRLGRPRCTSDBACE1

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-113880915-B Polypeptide for repairing mucous membrane injury or skin wound and application thereof 四川好医生攀西药业有限责任公司 2024-02-13 — — CN claimed
US-20230295233-A1 POLYPEPTIDE FOR REPAIRING MUCOSAL DAMAGE OR SKIN WOUND AND USE THEREOF SICHUAN GOODDOCTOR PANXI PHARMACEUTICAL CO., LTD. (CN) 2023-09-21 — — US claimed
CN-116133673-A Polypeptide for repairing mucous membrane injury or skin wound and application thereof 四川好医生攀西药业有限责任公司 2023-05-16 — — CN claimed
EP-4177259-A1 POLYPEPTIDE FOR REPAIRING MUCOSAL DAMAGE OR SKIN WOUND AND USE THEREOF Sichuan Gooddoctor Panxi Pharmaceutical Co. Ltd (CN) 2023-05-10 — — EP claimed
EP-4177259-A1 POLYPEPTIDE FOR REPAIRING MUCOSAL DAMAGE OR SKIN WOUND AND USE THEREOF Sichuan Gooddoctor Panxi Pharmaceutical Co. Ltd (CN) 2023-05-10 — — EP disclosed
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