SCHEMBL17364565

SCHEMBL17364565

CCc1ccnc(CNCC(=O)N(CC)CCN(C)C)c1

nearest known ligand 0.75

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM5B Q9UGL1 15/20 0.75
▸ KDM5C P41229 9/20 0.75
▸ KDM5A P29375 7/20 0.75
▸ KDM4A O75164 3/20 0.75
▸ KDM6B O15054 1/20 0.75
▸ KDM2B Q8NHM5 1/20 0.75
▸ KDM4C Q9H3R0 2/20 0.74
▸ KDM5D Q9BY66 1/20 0.73
▸ CYP2D6 P10635 1/20 0.36
▸ KDM4B O94953 1/20 0.35
▸ TLR9 Q9NR96 2/20 0.35
▸ TLR8 Q9NR97 2/20 0.35
▸ TLR7 Q9NYK1 2/20 0.35
▸ TSHR P16473 1/20 0.35

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
SCHEMBL15994347 0.92 KDM5B (0.73) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL18880308 0.91 KDM5B (0.74) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL16293178 0.91 KDM5B (0.74) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL19574688 0.89 KDM5B (0.69) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL15637682 0.86 KDM5B (0.86) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL15994214 0.86 KDM5B (0.72) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL15636679 0.86 KDM5B (1.00) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL29373338 0.85 KDM5B (1.00) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL15637431 0.85 KDM5B (1.00) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL15994301 0.85 KDM5B (1.00) KDM5BKDM5CKDM5AKDM4AKDM6B

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
US-9221801-B2 Inhibitors of histone demethylases EPITHERAPEUTICS APS (DK) 2015-12-29 — — US disclosed
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