SCHEMBL27781647

SCHEMBL27781647

CCC(C)n1cnc(C(=O)O)c1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KDM5A P29375 2/20 0.46
▸ KDM4C Q9H3R0 2/20 0.39
▸ KDM5B Q9UGL1 1/20 0.39
▸ ADA P00813 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38

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
SCHEMBL29215894 1.00 KDM5A (0.46) KDM5AKDM4CKDM5BADAKDM4E
SCHEMBL29215817 1.00 KDM5A (0.46) KDM5AKDM4CKDM5BADAKDM4E
SCHEMBL29663447 0.88 ADA (0.47) KDM5AKDM4CKDM5BADAKDM4E
SCHEMBL29663112 0.88 ADA (0.47) KDM5AKDM4CKDM5BADAKDM4E
SCHEMBL18040235 0.88 ADA (0.47) KDM5AKDM4CKDM5BADAKDM4E
SCHEMBL30291411 0.85 KDM5A (0.39) KDM5AKDM4CKDM5BADAKDM4E
SCHEMBL27781574 0.85 ADA (0.51) KDM5AADA
SCHEMBL29910466 0.85 KDM5A (0.39) KDM5AKDM4CKDM5BADAKDM4E
SCHEMBL28934818 0.84 ADA (0.43) KDM4CADAKDM4E
SCHEMBL710186 0.82 KDM5A (0.48) KDM5AADAKDM4E

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-115461338-B 3-azabicyclo (3.1.0) hexane derivatives having KDM5 inhibitory activity and uses thereof 小野药品工业株式会社 2024-02-20 — — CN disclosed
CN-101679293-A Urocanic acid derivatives useful for the treatment of immune-related and inflammatory diseases VALETTA HEALTH B V 2010-03-24 — — CN disclosed
Send feedback