SCHEMBL9376258

SCHEMBL9376258

Nc1cccc(CCc2ccc3nc(N)sc3c2)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.56
NPC1 O15118 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
BACE1 P56817 2/20 0.51
MAPT P10636 2/20 0.49
PIK3CA P42336 2/20 0.46
PI4KA P42356 2/20 0.46
PI4KB Q9UBF8 2/20 0.46
HTT P42858 2/20 0.45
AXL P30530 1/20 0.45
GFER P55789 1/20 0.45
GAA P10253 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
HTR1A P08908 1/20 0.45
DRD2 P14416 1/20 0.45
HTR2A P28223 1/20 0.45
CYP3A4 P08684 3/20 0.45
PIK3CD O00329 2/20 0.45
PIK3CG P48736 2/20 0.45
PIK3CB P42338 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
SCHEMBL9376809 0.82 PI4KA (0.56) RAB9ANPC1SMN1; SMN2MAPTPIK3CA
SCHEMBL9376945 0.80 RAB9A (0.49) RAB9ANPC1SMN1; SMN2MAPTCYP3A4
SCHEMBL9377503 0.77 RAB9A (0.78) RAB9ANPC1SMN1; SMN2MAPTPIK3CA
Hydrochloric Acid SCHEMBL7331641 0.76 RAB9A (0.66) RAB9ANPC1SMN1; SMN2MAPTPIK3CA
SCHEMBL113955 0.76 RAB9A (0.76) RAB9ANPC1SMN1; SMN2MAPTPIK3CA
SCHEMBL9722768 0.76 RAB9A (0.66) RAB9ANPC1SMN1; SMN2MAPTPIK3CA
SCHEMBL9376372 0.76 RAB9A (0.57) RAB9ANPC1SMN1; SMN2MAPTPIK3CA
SCHEMBL13780339 0.75 RAB9A (0.81) RAB9ANPC1SMN1; SMN2MAPTPIK3CA
SCHEMBL9375304 0.75 PI4KA (0.60) RAB9ANPC1SMN1; SMN2MAPTPIK3CA
SCHEMBL9379203 0.75 RAB9A (0.60) RAB9ANPC1SMN1; SMN2MAPTPIK3CA

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