SCHEMBL10688657

SCHEMBL10688657

Cc1nc2c3ccccc3ccn2c1CC1(C)N=CC=N1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.46
MAPK1 P28482 2/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HCRTR1 O43613 1/20 0.46
TP53 P04637 1/20 0.46
ALOX15 P16050 1/20 0.46
KDM4E B2RXH2 7/20 0.43
KMT2A Q03164 2/20 0.43
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 3/20 0.39
LMNA P02545 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.37
PARP1 P09874 1/20 0.36
PRKDC P78527 6/20 0.35
RXFP1 Q9HBX9 1/20 0.34
GALR3 O60755 1/20 0.34
ATP4A P20648 1/20 0.33
ATP4B P51164 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL12145159 0.75 MAPT (0.50) MAPTMAPK1RAB9ASMN1; SMN2HCRTR1
SCHEMBL10690155 0.75 ATP4A (0.55) MAPTMAPK1RAB9ASMN1; SMN2HCRTR1
SCHEMBL10691659 0.75 MAPT (0.50) MAPTMAPK1RAB9ASMN1; SMN2HCRTR1
SCHEMBL10694924 0.73 POLB (0.53) MAPTMAPK1RAB9ASMN1; SMN2HCRTR1
SCHEMBL10688636 0.73 MAPT (0.45) MAPTMAPK1RAB9ASMN1; SMN2HCRTR1
SCHEMBL12145158 0.72 MAPT (0.55) MAPTMAPK1RAB9ASMN1; SMN2HCRTR1
SCHEMBL10692844 0.70 KDM4E (0.53) MAPTMAPK1RAB9ASMN1; SMN2HCRTR1
SCHEMBL10694933 0.68 ADRA2A (0.50) MAPTMAPK1RAB9ASMN1; SMN2HCRTR1
SCHEMBL10689984 0.68 MAPT (0.44) MAPTMAPK1RAB9ASMN1; SMN2HCRTR1
SCHEMBL10689744 0.66 MAPT (0.46) MAPTMAPK1RAB9ASMN1; SMN2HCRTR1

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
US-4738967-A Imidazoisoquinoline compounds useful as anti-ulcerative agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-04-19 US disclosed
US-4686227-A Imidazoisoquinoline compounds useful as anti-ulcerative agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-08-11 US disclosed
EP-0165545-A2 Imidazoisoquinoline compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-12-27 EP disclosed