SCHEMBL10690375

SCHEMBL10690375

CSCc1c(C)nc2c3cccc(Cl)c3ccn12

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.34
CYP2A6 P11509 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
HCRTR1 O43613 1/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
ADRA2A P08913 1/20 0.32
KLKB1 P03952 1/20 0.32
MAP4K1 Q92918 1/20 0.32
ATP4A P20648 3/20 0.31
ATP4B P51164 3/20 0.31
TYMS P04818 1/20 0.31
PDE10A Q9Y233 1/20 0.31

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
SCHEMBL10693751 0.84 ATP4A (0.44) CYP1A2CYP2A6SMN1; SMN2HCRTR1TP53
SCHEMBL10693490 0.82 RAB9A (0.36) CYP1A2CYP2A6SMN1; SMN2HCRTR1TP53
SCHEMBL10694506 0.82 ATP4A (0.48) CYP1A2CYP2A6SMN1; SMN2HCRTR1TP53
SCHEMBL10691237 0.82 SMN1; SMN2 (0.36) CYP1A2CYP2A6SMN1; SMN2HCRTR1TP53
Iodide SCHEMBL10692587 0.81 CYP1A2 (0.33) CYP1A2CYP2A6SMN1; SMN2HCRTR1TP53
SCHEMBL10687438 0.80 MAPK1 (0.39) SMN1; SMN2HCRTR1TP53MAPTALOX15
SCHEMBL10689158 0.80 MAPT (0.34) CYP1A2CYP2A6SMN1; SMN2HCRTR1TP53
SCHEMBL10692769 0.80 MAPK1 (0.39) CYP1A2CYP2A6SMN1; SMN2HCRTR1TP53
SCHEMBL10688978 0.80 SMN1; SMN2 (0.34) CYP1A2CYP2A6SMN1; SMN2HCRTR1TP53
SCHEMBL10692077 0.79 CYP1A2 (0.42) CYP1A2CYP2A6SMN1; SMN2HCRTR1TP53

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