SCHEMBL18644698

SCHEMBL18644698

Cc1ncc(C(=O)O)nn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 4/20 0.41
KDM4E B2RXH2 8/20 0.40
NAPRT Q6XQN6 2/20 0.40
ALDH1A1 P00352 3/20 0.39
ALOX15 P16050 3/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
P4HTM Q9NXG6 5/20 0.39
P4HA1 P13674 1/20 0.39
MIF P14174 1/20 0.39
DAO P14920 1/20 0.38
L3MBTL1 Q9Y468 3/20 0.36
MAPK1 P28482 1/20 0.36
LMNA P02545 2/20 0.35
ASPH Q12797 1/20 0.35
KDM8 Q8N371 1/20 0.35
TSHR P16473 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
ACMSD Q8TDX5 1/20 0.34
SIRT6 Q8N6T7 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
SCHEMBL12500803 0.80 SIRT6 (0.46) LMNATSHRTDP1SIRT6GABRA1
SCHEMBL29185911 0.74 KDM4E (0.41) HCAR2KDM4ENAPRTALDH1A1ALOX15
SCHEMBL27252381 0.74 MEN1 (0.49) HCAR2KDM4ENAPRTALDH1A1ALOX15
SCHEMBL30241953 0.74 MEN1 (0.49) HCAR2KDM4ENAPRTALDH1A1ALOX15
SCHEMBL12500609 0.74 CYP1A2 (0.50) KDM4EALDH1A1HPGDHSD17B10L3MBTL1
SCHEMBL20929035 0.73 KDM4E (0.40) HCAR2KDM4ENAPRTALDH1A1ALOX15
SCHEMBL28291790 0.73 SIRT6 (0.42) HCAR2KDM4ENAPRTALDH1A1ALOX15
SCHEMBL70035 0.72 KDM4E (0.59) HCAR2KDM4ENAPRTALDH1A1ALOX15
SCHEMBL29930363 0.70 POLB (0.50) HCAR2KDM4ENAPRTALDH1A1P4HTM
SCHEMBL89539 0.70 POLB (0.50) HCAR2KDM4ENAPRTALDH1A1P4HTM

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
US-9598419-B1 Imidazotriazine and imidazodiazine compounds UNIVERSITE DE MONTREAL (CA) 2017-03-21 US disclosed
US-9598419-B1 Imidazotriazine and imidazodiazine compounds UNIVERSITE DE MONTREAL (CA) 2017-03-21 US disclosed