SCHEMBL28438423

SCHEMBL28438423

CCN(CCN(C)C)C(=O)CNCc1cc(C(=O)OC(CCC(=O)OC(C)C)NC(=O)C(F)(F)F)ccn1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KDM5B Q9UGL1 14/20 0.59
▸ KDM5C P41229 8/20 0.59
▸ KDM5A P29375 7/20 0.59
▸ KDM4C Q9H3R0 2/20 0.59
▸ KDM4A O75164 2/20 0.55
▸ KDM6B O15054 1/20 0.55
▸ KDM2B Q8NHM5 1/20 0.55
▸ KDM5D Q9BY66 1/20 0.54
▸ HTR5A P47898 1/20 0.30

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
SCHEMBL28436414 0.96 KDM5B (0.57) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL15636841 0.84 KDM5B (0.59) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL16291503 0.84 KDM5B (0.61) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL15636185 0.82 KDM5B (0.66) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL17763285 0.80 KDM5B (0.63) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL18708316 0.80 KDM5B (0.57) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL15635732 0.80 KDM5B (0.65) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL16292298 0.79 KDM5B (0.58) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL16291746 0.78 KDM5B (0.62) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL18686357 0.78 KDM5B (0.59) KDM5BKDM5CKDM5AKDM4CKDM4A

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-107434803-B Inhibitors of histone demethylases 吉利德科学公司 2020-05-05 — — CN disclosed
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