SCHEMBL9747413

SCHEMBL9747413

Nc1ncccc1OCc1ccc2ccccc2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.67
MAPK14 Q16539 1/20 0.67
RAB9A P51151 5/20 0.65
NPC1 O15118 4/20 0.65
MAPT P10636 1/20 0.65
HTT P42858 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
ROCK1 Q13464 1/20 0.48
CYP3A4 P08684 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CNR1 P21554 2/20 0.45
CNR2 P34972 2/20 0.45
ALOX5 P09917 3/20 0.43
NOS1 P29475 1/20 0.43
NOS2 P35228 1/20 0.43
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42

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
SCHEMBL1138274 0.82 NPC1 (0.68) RAB9ANPC1MAPTSMN1; SMN2CYP3A4
SCHEMBL105010 0.80 LTA4H (1.00) LTA4HMAPK14RAB9ANPC1MAPT
Bromide SCHEMBL5755659 0.79 LTA4H (0.96) LTA4HMAPK14RAB9ANPC1MAPT
Hydrochloric Acid SCHEMBL2655772 0.79 LTA4H (0.96) LTA4HMAPK14RAB9ANPC1MAPT
SCHEMBL23631385 0.79 LTA4H (0.77) LTA4HMAPK14RAB9ANPC1MAPT
SCHEMBL6079682 0.79 NPC1 (0.65) LTA4HMAPK14RAB9ANPC1MAPT
SCHEMBL9116755 0.79 NPC1 (1.00) LTA4HMAPK14RAB9ANPC1MAPT
SCHEMBL23631389 0.78 LTA4H (0.71) LTA4HMAPK14RAB9ANPC1MAPT
SCHEMBL23631386 0.78 LTA4H (0.74) LTA4HMAPK14RAB9ANPC1MAPT
SCHEMBL6079578 0.78 LTA4H (0.75) LTA4HMAPK14RAB9ANPC1MAPT

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-0204285-B1 IMIDAZOHETEROCYCLIC COMPOUNDS PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-01-15 EP disclosed
US-4725601-A Certain imidazo[1,2-a]pyridines useful in the treatment of ulcers FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-02-16 US disclosed
EP-0204285-A1 Imidazoheterocyclic compounds processes for preparation thereof and pharmaceutical compositions comprising them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-12-10 EP disclosed