SCHEMBL9375304

SCHEMBL9375304

Nc1nc2ccc(CCc3cccnc3)cc2s1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 6/20 0.60
PI4KB Q9UBF8 6/20 0.60
PIK3CD O00329 5/20 0.60
PIK3CA P42336 5/20 0.60
PIP5K1C O60331 3/20 0.60
RAB9A P51151 3/20 0.58
NPC1 O15118 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
DRD2 P14416 1/20 0.54
KCNH2 Q12809 1/20 0.54
PIK3CG P48736 4/20 0.49
PIK3CB P42338 3/20 0.49
MAPT P10636 1/20 0.49
CYP3A4 P08684 2/20 0.48
CYP2D6 P10635 1/20 0.46
AXL P30530 1/20 0.45
GFER P55789 1/20 0.45
GAA P10253 1/20 0.45
HTT P42858 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL9377503 0.82 RAB9A (0.78) PI4KAPI4KBPIK3CDPIK3CAPIP5K1C
SCHEMBL9381341 0.80 RAB9A (0.55) PIK3CARAB9ANPC1SMN1; SMN2PIK3CG
SCHEMBL9376809 0.77 PI4KA (0.56) PI4KAPI4KBPIK3CDPIK3CAPIP5K1C
SCHEMBL9382376 0.76 RAB9A (0.55) PI4KAPI4KBPIK3CDPIK3CAPIP5K1C
Hydrochloric Acid SCHEMBL7331641 0.76 RAB9A (0.66) PI4KAPI4KBPIK3CDPIK3CAPIP5K1C
SCHEMBL113955 0.76 RAB9A (0.76) PI4KAPI4KBPIK3CDPIK3CAPIP5K1C
SCHEMBL9722768 0.76 RAB9A (0.66) PI4KAPI4KBPIK3CDPIK3CAPIP5K1C
SCHEMBL3710444 0.75 PIK3CA (1.00) PI4KAPI4KBPIK3CDPIK3CAPIP5K1C
SCHEMBL13780339 0.75 RAB9A (0.81) PI4KAPI4KBPIK3CDPIK3CAPIP5K1C
SCHEMBL9376258 0.75 RAB9A (0.56) PI4KAPI4KBPIK3CDPIK3CAPIP5K1C

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