SCHEMBL2877274

SCHEMBL2877274

CCNC(=O)c1ccnc(-c2cc(C(=O)OC)ccn2)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5B Q9UGL1 2/20 0.67
KDM4E B2RXH2 5/20 0.66
KDM5C P41229 3/20 0.66
KDM6B O15054 2/20 0.66
KDM4C Q9H3R0 2/20 0.66
KDM2A Q9Y2K7 2/20 0.66
KDM3A Q9Y4C1 2/20 0.66
JMJD6 Q6NYC1 5/20 0.58
MAOB P27338 1/20 0.51
KDM5A P29375 2/20 0.48
NPC1 O15118 1/20 0.47
HPGD P15428 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ALOX15 P16050 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
HDAC1 Q13547 3/20 0.46
KDM1A O60341 2/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC8 Q9BY41 1/20 0.46

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
SCHEMBL7963734 0.91 KDM4E (0.59) KDM5BKDM4EKDM5CKDM6BKDM4C
SCHEMBL29894587 0.86 KDM4E (0.86) KDM5BKDM4EKDM5CKDM6BKDM4C
SCHEMBL70279 0.86 KDM4E (0.86) KDM5BKDM4EKDM5CKDM6BKDM4C
SCHEMBL13383551 0.85 KDM4E (0.69) KDM5BKDM4EKDM5CKDM6BKDM4C
Hydrochloric Acid SCHEMBL6504834 0.84 KDM4E (0.83) KDM5BKDM4EKDM5CKDM6BKDM4C
SCHEMBL6514670 0.84 KDM4E (0.83) KDM5BKDM4EKDM5CKDM6BKDM4C
SCHEMBL14291398 0.84 KDM4E (0.52) KDM5BKDM4EKDM5CKDM6BKDM4C
SCHEMBL2714272 0.84 KDM4E (0.51) KDM5BKDM4EKDM5CKDM6BKDM4C
SCHEMBL2716296 0.84 KDM5B (0.48) KDM5BKDM4EKDM5CKDM6BKDM4C
SCHEMBL10789252 0.83 SMN1; SMN2 (0.56) KDM5BKDM4ERAB9ASMN1; SMN2L3MBTL1

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
WO-2010043866-A2 HISTONE LYSINE DEMETHYLASE INHIBITORS ISIS INNOVATION LIMITED (GB) 2010-04-22 WO disclosed