SCHEMBL30402069

SCHEMBL30402069

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(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)C(C)C

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 3/20 0.57
▸ MAOB P27338 1/20 0.53
▸ KDM5A P29375 1/20 0.53
▸ KDM1B Q8NB78 1/20 0.53
▸ MAPK8 P45983 1/20 0.50
▸ MAPK9 P45984 1/20 0.50
▸ MAPK10 P53779 1/20 0.50
▸ REN P00797 5/20 0.48
▸ NPY2R P49146 7/20 0.48
▸ NPY4R P50391 7/20 0.48
▸ NPY5R Q15761 7/20 0.48
▸ NPY1R P25929 5/20 0.48
▸ TFPI P10646 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
SCHEMBL30311454 1.00 KDM1A (0.57) KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL30401159 0.99 KDM1A (0.57) KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL30311228 0.99 KDM1A (0.57) KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL30401031 0.99 KDM1A (0.57) KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL30401187 0.99 KDM1A (0.57) KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL30401010 0.99 KDM1A (0.56) KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL30401044 0.99 KDM1A (0.56) KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL30311303 0.99 KDM1A (0.57) KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL30401069 0.98 KDM1A (0.57) KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL30311090 0.98 KDM1A (0.56) KDM1AMAOBKDM5AKDM1BMAPK8

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
Send feedback