SCHEMBL20978807

SCHEMBL20978807

O=C(O)c1ccnc(C2=CN(CCN3CCOCC3)CN2)c1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM5B Q9UGL1 4/20 0.62
▸ KDM5A P29375 3/20 0.62
▸ KDM2B Q8NHM5 3/20 0.50
▸ PIK3CA P42336 1/20 0.48
▸ JMJD6 Q6NYC1 1/20 0.43
▸ KDM4C Q9H3R0 7/20 0.43
▸ KDM5C P41229 5/20 0.43
▸ KDM4A O75164 3/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ MAPT P10636 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ KDM4B O94953 1/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ KDM2A Q9Y2K7 3/20 0.41
▸ KDM3A Q9Y4C1 3/20 0.41
▸ KDM6B O15054 2/20 0.41
▸ P4HA1 P13674 1/20 0.40

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
SCHEMBL20978859 0.83 KDM2B (0.44) KDM5BKDM5AKDM2BJMJD6KDM4C
SCHEMBL20978805 0.81 KDM5B (0.59) KDM5BKDM5AKDM2BJMJD6KDM4C
SCHEMBL20978910 0.77 KDM5A (0.60) KDM5BKDM5AKDM2BJMJD6KDM4C
SCHEMBL16034328 0.77 KDM5A (1.00) KDM5BKDM5AKDM2BKDM4CKDM4A
SCHEMBL20978938 0.77 KDM4C (0.67) KDM5BKDM5AKDM2BKDM4CKDM5C
SCHEMBL20978723 0.76 KDM2B (0.38) KDM5BKDM5AKDM2BJMJD6KDM4C
SCHEMBL20979006 0.76 JMJD6 (0.54) KDM5BKDM5AKDM2BJMJD6KDM4C
SCHEMBL20978804 0.75 KDM2B (0.63) KDM5BKDM5AKDM2BJMJD6KDM4C
SCHEMBL20978722 0.75 KDM4C (0.68) KDM5BKDM5AKDM2BJMJD6KDM4C
SCHEMBL20979022 0.74 KDM4C (0.46) KDM5BKDM5AKDM2BJMJD6KDM4C

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-2969007-B1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RES INC (US) 2019-05-08 — — EP disclosed
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