SCHEMBL29129147

SCHEMBL29129147

NC(=O)c1ccnc(CNCC(=O)O)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5B Q9UGL1 15/20 0.60
KDM5C P41229 10/20 0.60
KDM5A P29375 6/20 0.60
KDM4C Q9H3R0 3/20 0.60
KDM5D Q9BY66 1/20 0.60
KDM4A O75164 4/20 0.50
KDM4B O94953 3/20 0.50
KDM6B O15054 1/20 0.49
KDM2B Q8NHM5 1/20 0.49
CYP1A2 P05177 1/20 0.40
POLB P06746 1/20 0.40
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
MBOAT4 Q96T53 1/20 0.39
GABRP O00591 1/20 0.37
GABRD O14764 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB1 P18505 1/20 0.37

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
SCHEMBL509374 0.81 KDM5B (0.50) KDM5BKDM5CKDM5AKDM4CKDM5D
SCHEMBL11403167 0.80 KDM5B (0.43) KDM5BKDM5CKDM5AKDM4CKDM5D
SCHEMBL18160696 0.78 KDM5B (0.45) KDM5BKDM5CKDM5AKDM4CKDM5D
SCHEMBL25380189 0.76 KDM5B (1.00) KDM5BKDM5CKDM5AKDM4CKDM5D
SCHEMBL23120658 0.76 KDM5B (0.52) KDM5BKDM5CKDM5AKDM4CKDM5D
SCHEMBL509023 0.75 CYP1A2 (0.47) KDM5BKDM5CKDM5AKDM4CKDM5D
SCHEMBL7668183 0.75 CYP1A2 (0.47) KDM5BKDM5CKDM5AKDM4CKDM5D
SCHEMBL8594535 0.75 CYP1A2 (0.47) KDM5BKDM5CKDM5AKDM4CKDM5D
SCHEMBL30607268 0.75 CYP1A2 (0.47) KDM5BKDM5CKDM5AKDM4CKDM5D
SCHEMBL24510177 0.75 KDM5B (0.40) KDM5BKDM5CKDM5AKDM4CKDM5D

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117279636-A Methods and compounds for modulating myotonic muscular dystrophy type 1 设计治疗公司 2023-12-22 CN disclosed