SCHEMBL29907677

SCHEMBL29907677

O=C(O)c1cnc(-c2ncco2)cn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.40
NAPRT Q6XQN6 2/20 0.40
HCAR2 Q8TDS4 1/20 0.40
BACE1 P56817 1/20 0.39
HPGDS O60760 1/20 0.37
ASPH Q12797 3/20 0.36
KDM8 Q8N371 2/20 0.36
P4HTM Q9NXG6 4/20 0.35
P4HA1 P13674 3/20 0.35
MIF P14174 1/20 0.35
ALDH1A1 P00352 4/20 0.34
KDM6B O15054 1/20 0.34
TET3 O43151 1/20 0.34
KDM4A O75164 1/20 0.34
BBOX1 O75936 1/20 0.34
MAPT P10636 1/20 0.34
KDM5A P29375 1/20 0.34
KDM5C P41229 1/20 0.34
KDM4D Q6B0I6 1/20 0.34
TET2 Q6N021 1/20 0.34

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
SCHEMBL29906724 0.88 SIRT6 (0.44) BACE1HPGDSALDH1A1HDAC4GSK3B
SCHEMBL29907727 0.81 GLRA3 (0.45) KDM4EBACE1ALDH1A1KDM6BMAPT
SCHEMBL12248226 0.81 GLRA3 (0.45) KDM4EBACE1ALDH1A1KDM6BMAPT
SCHEMBL2436714 0.72 ALDH1A1 (0.36) KDM4EHPGDSASPHKDM8ALDH1A1
Iodide SCHEMBL7459681 0.72 KDM4E (0.54) KDM4ENAPRTHCAR2ASPHKDM8
SCHEMBL70035 0.72 KDM4E (0.59) KDM4ENAPRTHCAR2ASPHKDM8
SCHEMBL7940958 0.71 HPGDS (0.37) BACE1HPGDSLTA4H
SCHEMBL15896821 0.70 KDM4E (0.52) KDM4ENAPRTHCAR2HPGDSASPH
Water SCHEMBL6129699 0.70 KDM4E (0.52) KDM4ENAPRTHCAR2ASPHKDM8
SCHEMBL7767700 0.70 KDM4E (0.56) KDM4ENAPRTHCAR2ASPHKDM8

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115181092-A Pyrazine compounds and uses thereof 迪哲(江苏)医药股份有限公司 2022-10-14 CN disclosed
CN-112279837-B Pyrazine compounds and uses thereof 迪哲(江苏)医药股份有限公司 2022-08-09 CN disclosed