SCHEMBL9380475

SCHEMBL9380475

Nc1nc2ccc(C(O)c3ccccn3)cc2s1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 6/20 0.54
PI4KB Q9UBF8 6/20 0.54
PIK3CD O00329 6/20 0.54
PIK3CA P42336 6/20 0.54
PIK3CG P48736 5/20 0.54
RAB9A P51151 4/20 0.54
NPC1 O15118 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
SCN4A P35499 1/20 0.54
PIP5K1C O60331 3/20 0.51
SCD O00767 1/20 0.48
HTT P42858 2/20 0.47
GAA P10253 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SYK P43405 1/20 0.45
MAPT P10636 2/20 0.44
TP53 P04637 2/20 0.44
AXL P30530 1/20 0.43
GFER P55789 1/20 0.43
CYP3A4 P08684 1/20 0.43

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
SCHEMBL21177823 0.82 RAB9A (0.60) PI4KAPI4KBPIK3CDPIK3CAPIK3CG
SCHEMBL8548185 0.78 RAB9A (0.59) PI4KAPI4KBPIK3CDPIK3CAPIK3CG
SCHEMBL8122351 0.74 RAB9A (0.76) PI4KAPI4KBPIK3CDPIK3CAPIK3CG
SCHEMBL17064838 0.72 SLC6A2 (0.47) PI4KAPI4KBMAPTCYP3A4ALDH1A1
SCHEMBL31067503 0.72 SLC6A2 (0.47) PI4KAPI4KBMAPTCYP3A4ALDH1A1
SCHEMBL5655372 0.72 SLC6A3 (0.46) PI4KAPI4KBSCDL3MBTL1MAPT
SCHEMBL5655180 0.72 SLC6A3 (0.46) PI4KAPI4KBSCDL3MBTL1MAPT
SCHEMBL5655181 0.72 SLC6A3 (0.46) PI4KAPI4KBSCDL3MBTL1MAPT
SCHEMBL17064435 0.71 SLC6A3 (0.39) SCDL3MBTL1MAPTCYP3A4ALDH1A1
SCHEMBL31067445 0.71 SLC6A3 (0.39) SCDL3MBTL1MAPTCYP3A4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0356234-B1 New Benzazole compounds, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1994-05-11 EP disclosed
US-5047411-A Antiulcer Agents, H2-Receptor Antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-09-10 US disclosed
EP-0356234-A2 New Benzazole compounds, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-02-28 EP disclosed