SCHEMBL26071075

SCHEMBL26071075

Nc1[nH]nnc1-c1cccc(OCc2cscn2)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.36
CYSLTR1 Q9Y271 1/20 0.36
KDM4E B2RXH2 1/20 0.36
NOTUM Q6P988 1/20 0.35
SLC22A12 Q96S37 1/20 0.35
PIM1 P11309 1/20 0.34
DYRK1A Q13627 1/20 0.34
MAPT P10636 2/20 0.34
GAA P10253 1/20 0.34
PIK3CD O00329 2/20 0.34
PIK3CA P42336 2/20 0.34
PIK3CB P42338 2/20 0.34
PIK3CG P48736 2/20 0.34
PRKDC P78527 2/20 0.34
IGF1R P08069 2/20 0.33
HTT P42858 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 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
SCHEMBL18006429 0.84 CYP11B1 (0.37) CYSLTR2CYSLTR1SLC22A12MAPTGAA
SCHEMBL26071043 0.81 CHEK1 (0.43) CYSLTR2CYSLTR1NOTUMSLC22A12MAPT
SCHEMBL26071010 0.79 CYP11B1 (0.38) CYSLTR2CYSLTR1SLC22A12PIK3CDPIK3CA
SCHEMBL26071083 0.77 SLC22A12 (0.38) KDM4ENOTUMSLC22A12MAPTGAA
SCHEMBL26071016 0.77 SLC22A12 (0.38) CYSLTR2CYSLTR1KDM4ENOTUMSLC22A12
SCHEMBL26071059 0.77 PFKFB3 (0.39) CYSLTR2CYSLTR1NOTUMSLC22A12PIK3CD
SCHEMBL26071012 0.77 HSD17B10 (0.38) CYSLTR2CYSLTR1KDM4ENOTUMSLC22A12
SCHEMBL26071014 0.76 FFAR1 (0.38) CYSLTR2CYSLTR1KDM4ENOTUMSLC22A12
SCHEMBL26071079 0.74 IGF1R (0.35) CYSLTR2CYSLTR1KDM4ENOTUMSLC22A12
SCHEMBL26070984 0.74 IGF1R (0.42) KDM4EDYRK1AMAPTPIK3CDPIK3CA

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