SCHEMBL29414611

SCHEMBL29414611

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

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 3/20 0.55
▸ EPHA2 P29317 4/20 0.51
▸ MAOB P27338 1/20 0.50
▸ KDM5A P29375 1/20 0.50
▸ KDM1B Q8NB78 1/20 0.50
▸ MAPK8 P45983 1/20 0.48
▸ MAPK9 P45984 1/20 0.48
▸ MAPK10 P53779 1/20 0.48
▸ KEAP1 Q14145 1/20 0.46
▸ REN P00797 3/20 0.44
▸ CALCRL Q16602 1/20 0.42
▸ RAMP3 O60896 2/20 0.41
▸ CALCR P30988 2/20 0.41

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
SCHEMBL29414617 0.98 KDM1A (0.57) KDM1AEPHA2MAOBKDM5AKDM1B
SCHEMBL29414603 0.87 KDM1A (0.47) KDM1AEPHA2MAOBKDM5AKDM1B
SCHEMBL3865485 0.84 MAPK8 (0.50) KDM1AEPHA2MAOBKDM5AKDM1B
SCHEMBL29414612 0.84 KDM1A (0.50) KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL29855959 0.83 KDM1A (0.47) KDM1AEPHA2MAOBKDM5AKDM1B
SCHEMBL31437189 0.83 MAPK8 (0.54) KDM1AEPHA2MAOBKDM5AKDM1B
SCHEMBL31410825 0.83 MAPK8 (0.56) KDM1AMAPK8MAPK9MAPK10KEAP1
SCHEMBL31575682 0.82 KDM1A (0.57) KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL31573976 0.82 KDM1A (0.52) KDM1AMAOBKDM5AKDM1BMAPK8
SCHEMBL30658576 0.82 KDM1A (0.51) KDM1AEPHA2MAOBKDM5AKDM1B

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
US-20230310702-A1 SELF-ASSEMBLING PEPTIDES, PREPARATION METHODS, SELF-ASSEMBLING PEPTIDE FORMULATIONS AND USE SUCCESS BIO-TECH CO., LTD. (CN) 2023-10-05 — — US claimed
WO-2022028036-A1 SELF-ASSEMBLING POLYPEPTIDE, PREPARATION METHOD THEREFOR, SELF-ASSEMBLING POLYPEPTIDE PREPARATION AND USE THEREOF 赛克赛斯生物科技股份有限公司 2022-02-10 — — WO claimed
US-20230310702-A1 SELF-ASSEMBLING PEPTIDES, PREPARATION METHODS, SELF-ASSEMBLING PEPTIDE FORMULATIONS AND USE SUCCESS BIO-TECH CO., LTD. (CN) 2023-10-05 — — US disclosed
WO-2022028036-A1 SELF-ASSEMBLING POLYPEPTIDE, PREPARATION METHOD THEREFOR, SELF-ASSEMBLING POLYPEPTIDE PREPARATION AND USE THEREOF 赛克赛斯生物科技股份有限公司 2022-02-10 — — WO disclosed
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