SCHEMBL10690457

SCHEMBL10690457

Cc1nc2c3cccc(Cl)c3ccn2c1N

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 3/20 0.42
ATP4A P20648 4/20 0.42
ATP4B P51164 4/20 0.42
CYP1A2 P05177 2/20 0.39
CYP2A6 P11509 2/20 0.39
HSP90AB1 P08238 1/20 0.36
KLKB1 P03952 1/20 0.36
MAP4K1 Q92918 1/20 0.36
PARP1 P09874 1/20 0.35
TYMS P04818 2/20 0.34
HCRTR1 O43613 1/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
MAPK1 P28482 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PRMT5 O14744 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
SCHEMBL10692077 0.84 CYP1A2 (0.42) NR4A2ATP4AATP4BCYP1A2CYP2A6
SCHEMBL10689772 0.81 NR4A2 (0.38) NR4A2CYP1A2CYP2A6HSP90AB1KLKB1
SCHEMBL8182302 0.80 GAA (0.45) NR4A2MAPTRAB9ASMN1; SMN2
SCHEMBL10685737 0.79 SMN1; SMN2 (0.46) CYP1A2KLKB1MAP4K1HCRTR1TP53
SCHEMBL31669621 0.79 ATP4A (0.54) NR4A2ATP4AATP4BRAB9A
SCHEMBL10692146 0.78 NOTUM (0.36) NR4A2CYP1A2CYP2A6KLKB1MAP4K1
SCHEMBL10692304 0.78 KMT2A (0.43) NR4A2CYP1A2CYP2A6KLKB1MAP4K1
SCHEMBL10693751 0.78 ATP4A (0.44) ATP4AATP4BCYP1A2CYP2A6KLKB1
SCHEMBL10690142 0.77 ALDH1A1 (0.49) CYP1A2CYP2A6KLKB1MAP4K1HCRTR1
SCHEMBL10690311 0.77 SMN1; SMN2 (0.47) CYP1A2HCRTR1TP53MAPTALOX15

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