SCHEMBL19676435

SCHEMBL19676435

C=C(OC(C)CC(C)=O)c1ccnc(CNCC(=O)N(CC)CCN(C)C)c1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM5B Q9UGL1 15/20 0.66
▸ KDM5C P41229 9/20 0.66
▸ KDM5A P29375 7/20 0.66
▸ KDM4A O75164 3/20 0.66
▸ KDM6B O15054 1/20 0.66
▸ KDM2B Q8NHM5 1/20 0.66
▸ KDM4C Q9H3R0 2/20 0.66
▸ KDM5D Q9BY66 1/20 0.65
▸ ACKR3 P25106 2/20 0.34
▸ TOP2A P11388 1/20 0.33
▸ KDM4B O94953 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ WDR5 P61964 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
SCHEMBL15637333 0.92 KDM5B (0.72) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL18708513 0.86 KDM5B (0.59) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL18708382 0.83 KDM5B (0.69) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL15637682 0.80 KDM5B (0.86) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL15636679 0.80 KDM5B (1.00) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL29373338 0.80 KDM5B (1.00) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL15637431 0.80 KDM5B (1.00) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL18708524 0.79 KDM5B (0.83) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL25380189 0.79 KDM5B (1.00) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL19676368 0.78 KDM5B (0.80) 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
EP-3023415-B1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES INC (US) 2017-12-06 — — EP disclosed
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