SCHEMBL30400667

SCHEMBL30400667

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)C(C)C)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 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CALCRL Q16602 2/20 0.49
▸ NPY2R P49146 7/20 0.49
▸ NPY4R P50391 7/20 0.49
▸ NPY5R Q15761 7/20 0.49
▸ NPY1R P25929 5/20 0.49
▸ KDM1A O60341 3/20 0.49
▸ MAOB P27338 1/20 0.49
▸ KDM5A P29375 1/20 0.49
▸ KDM1B Q8NB78 1/20 0.49
▸ CTSD P07339 1/20 0.47
▸ BACE1 P56817 1/20 0.47
▸ TFPI P10646 3/20 0.47
▸ NTSR2 O95665 2/20 0.47
▸ NTSR1 P30989 2/20 0.47
▸ SORT1 Q99523 2/20 0.47

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
SCHEMBL30401223 0.99 CALCRL (0.49) CALCRLNPY2RNPY4RNPY5RNPY1R
SCHEMBL30401358 0.99 CALCRL (0.50) CALCRLNPY2RNPY4RNPY5RNPY1R
SCHEMBL30399534 0.99 CALCRL (0.50) CALCRLNPY2RNPY4RNPY5RNPY1R
SCHEMBL30400966 0.99 CALCRL (0.50) CALCRLNPY2RNPY4RNPY5RNPY1R
SCHEMBL30400261 0.99 CALCRL (0.49) CALCRLNPY2RNPY4RNPY5RNPY1R
SCHEMBL30400974 0.99 CALCRL (0.49) CALCRLNPY2RNPY4RNPY5RNPY1R
SCHEMBL30401793 0.98 CALCRL (0.50) CALCRLNPY2RNPY4RNPY5RNPY1R
SCHEMBL30401373 0.98 CALCRL (0.50) CALCRLNPY2RNPY4RNPY5RNPY1R
SCHEMBL30401045 0.98 CALCRL (0.50) CALCRLNPY2RNPY4RNPY5RNPY1R
SCHEMBL30401770 0.98 CALCRL (0.49) CALCRLNPY2RNPY4RNPY5RNPY1R

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-116003529-A Polypeptide and application thereof in repairing mucous membrane injury or skin injury 四川好医生攀西药业有限责任公司 2023-04-25 — — CN claimed
CN-116003529-A Polypeptide and application thereof in repairing mucous membrane injury or skin injury 四川好医生攀西药业有限责任公司 2023-04-25 — — CN disclosed
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