SCHEMBL30401005

SCHEMBL30401005

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)N)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)NCC(=O)O)C(C)C

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 3/20 0.50
▸ MAOB P27338 1/20 0.48
▸ KDM5A P29375 1/20 0.48
▸ KDM1B Q8NB78 1/20 0.48
▸ TFPI P10646 5/20 0.48
▸ NPY2R P49146 7/20 0.46
▸ NPY4R P50391 7/20 0.46
▸ NPY5R Q15761 7/20 0.46
▸ NPY1R P25929 5/20 0.46
▸ KEAP1 Q14145 1/20 0.46
▸ OPRD1 P41143 1/20 0.45

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
SCHEMBL30401747 0.97 KEAP1 (0.50) KDM1AMAOBKDM5AKDM1BTFPI
SCHEMBL30401154 0.95 KEAP1 (0.47) KDM1AMAOBKDM5AKDM1BTFPI
SCHEMBL30400686 0.94 KDM1A (0.50) KDM1AMAOBKDM5AKDM1BTFPI
SCHEMBL30401020 0.94 KDM1A (0.50) KDM1AMAOBKDM5AKDM1BTFPI
SCHEMBL30311366 0.94 KDM1A (0.50) KDM1AMAOBKDM5AKDM1BTFPI
SCHEMBL30402000 0.94 KDM1A (0.50) KDM1AMAOBKDM5AKDM1BTFPI
SCHEMBL30401182 0.94 KDM1A (0.50) KDM1AMAOBKDM5AKDM1BNPY2R
SCHEMBL30401660 0.94 KDM1A (0.50) KDM1AMAOBKDM5AKDM1BNPY2R
SCHEMBL30401201 0.94 KDM1A (0.49) KDM1AMAOBKDM5AKDM1BTFPI
SCHEMBL30400676 0.93 KDM1A (0.49) KDM1AMAOBKDM5AKDM1BTFPI

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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