SCHEMBL19676491

SCHEMBL19676491

C=CCN(CCN(C)C)C(=O)CNCc1cc(C(=O)OCC(F)F)ccn1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM5B Q9UGL1 16/20 0.67
▸ KDM5C P41229 10/20 0.67
▸ KDM5A P29375 7/20 0.67
▸ KDM4C Q9H3R0 2/20 0.67
▸ KDM4A O75164 4/20 0.57
▸ KDM6B O15054 1/20 0.57
▸ KDM2B Q8NHM5 1/20 0.57
▸ KDM5D Q9BY66 1/20 0.56
▸ JMJD6 Q6NYC1 2/20 0.41
▸ ADRB2 P07550 1/20 0.33
▸ ADRB1 P08588 1/20 0.33
▸ ADRB3 P13945 1/20 0.33
▸ KDM4B O94953 2/20 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
SCHEMBL15637410 0.91 KDM5B (0.81) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL19676368 0.84 KDM5B (0.80) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL18708382 0.84 KDM5B (0.69) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL18708524 0.82 KDM5B (0.83) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL15637431 0.81 KDM5B (1.00) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL29373338 0.81 KDM5B (1.00) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL16291430 0.79 KDM5B (0.83) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL19676470 0.78 KDM5B (0.86) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL16291631 0.78 KDM5B (0.54) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL16291798 0.78 KDM5B (0.81) 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
EP-3023415-B1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES INC (US) 2017-12-06 — — EP disclosed
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