SCHEMBL24655834

SCHEMBL24655834

CN(C)CCn1cnc(N)c1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 1/20 0.44
KDM5B Q9UGL1 1/20 0.44
KDM2B Q8NHM5 2/20 0.34
HRH3 Q9Y5N1 2/20 0.33
KDM4A O75164 2/20 0.32
KDM4C Q9H3R0 2/20 0.32
PDE4A P27815 3/20 0.32
PDE4B Q07343 3/20 0.32
PDE4C Q08493 3/20 0.32
PDE4D Q08499 3/20 0.32
NOS3 P29474 2/20 0.31
NOS1 P29475 2/20 0.31
NOS2 P35228 2/20 0.31
KDM4E B2RXH2 1/20 0.31
HTR6 P50406 1/20 0.31

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
SCHEMBL18516697 0.78 KDM5A (0.46) KDM5AKDM5BKDM2B
SCHEMBL24925524 0.78
SCHEMBL2974423 0.77 KDM2B (0.33) KDM5AKDM5BKDM2BKDM4AKDM4C
SCHEMBL306663 0.77 KDM5A (0.44) KDM5AKDM5BKDM2BKDM4AKDM4C
SCHEMBL5199907 0.77 KDM5A (0.44) KDM5AKDM5BKDM2BKDM4AKDM4C
SCHEMBL2976275 0.76 CARM1 (0.49)
Hydrochloric Acid SCHEMBL22833798 0.76 KDM5A (0.40) KDM5AKDM5B
SCHEMBL10272686 0.76 KDM5A (0.43) KDM5AKDM5BKDM2BHRH3KDM4A
SCHEMBL24655835 0.75
SCHEMBL20757533 0.75 KDM5A (0.44) KDM5AKDM5BKDM2BHTR6

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
WO-2022234271-A1 HETEROARYL COMPOUNDS USEFUL IN THE TREATMENT OF COGNITIVE DISORDERS UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2022-11-10 WO disclosed