SCHEMBL26071014

SCHEMBL26071014

Cc1cc(COc2cccc(-c3nn[nH]c3N)c2)nn1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.38
SLC22A12 Q96S37 1/20 0.38
IGF1R P08069 2/20 0.36
CYSLTR2 Q9NS75 1/20 0.35
CYSLTR1 Q9Y271 1/20 0.35
GABRA1 P14867 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34
GABRA5 P31644 1/20 0.34
GABRA3 P34903 1/20 0.34
MAPT P10636 4/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 2/20 0.34
KDM4E B2RXH2 1/20 0.34
GLA P06280 1/20 0.34
HIF1A Q16665 1/20 0.34
JAK2 O60674 1/20 0.34
JAK3 P52333 1/20 0.34
NOS3 P29474 2/20 0.33
NOS1 P29475 2/20 0.33

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
SCHEMBL26070976 0.87 PTGS2 (0.41) FFAR1IGF1RCYSLTR2CYSLTR1GABRA1
SCHEMBL18006398 0.85 CYP11B1 (0.37) FFAR1SLC22A12CYSLTR2CYSLTR1GABRA1
SCHEMBL26071059 0.83 PFKFB3 (0.39) FFAR1SLC22A12IGF1RCYSLTR2CYSLTR1
SCHEMBL26071016 0.79 SLC22A12 (0.38) FFAR1SLC22A12CYSLTR2CYSLTR1MAPT
SCHEMBL26070973 0.79 GABRA1 (0.41) FFAR1SLC22A12IGF1RGABRA1GABRG2
SCHEMBL26071043 0.78 CHEK1 (0.43) SLC22A12IGF1RCYSLTR2CYSLTR1MAPT
SCHEMBL26070967 0.78 CNR1 (0.36) SLC22A12IGF1RCYSLTR2CYSLTR1GABRA1
SCHEMBL26071055 0.78 ADORA2A (0.38) SLC22A12IGF1RCYSLTR2CYSLTR1GABRA1
SCHEMBL26070961 0.77 MEN1 (0.42) SLC22A12IGF1RGABRA1GABRG2GABRB3
SCHEMBL26071075 0.76 CYSLTR2 (0.36) SLC22A12IGF1RCYSLTR2CYSLTR1GABRA1

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-4219477-A1 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2023-08-02 EP disclosed