SCHEMBL10694491

SCHEMBL10694491

COS(=O)(=O)[O-].Cc1nc2c3cccc(Cl)c3ccn2c1C[N+](C)(C)C

nearest known ligand 0.36

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.32
HCRTR1 O43613 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
ALOX15 P16050 1/20 0.32
MAPK1 P28482 1/20 0.32
RAB9A P51151 1/20 0.32
GHSR Q92847 1/20 0.32
PKM P14618 1/20 0.30

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
Iodide SCHEMBL10692587 0.88 CYP1A2 (0.33) SMN1; SMN2HCRTR1TP53MAPTALOX15
SCHEMBL10689744 0.85 MAPT (0.46) SMN1; SMN2HCRTR1TP53MAPTALOX15
SCHEMBL10688978 0.78 SMN1; SMN2 (0.34) SMN1; SMN2HCRTR1TP53MAPTALOX15
SCHEMBL10691237 0.77 SMN1; SMN2 (0.36) SMN1; SMN2HCRTR1TP53MAPTALOX15
SCHEMBL10690375 0.75 CYP1A2 (0.34) SMN1; SMN2HCRTR1TP53MAPTALOX15
SCHEMBL10693751 0.75 ATP4A (0.44) SMN1; SMN2HCRTR1TP53MAPTALOX15
SCHEMBL10687438 0.73 MAPK1 (0.39) SMN1; SMN2HCRTR1TP53MAPTALOX15
SCHEMBL10689158 0.73 MAPT (0.34) SMN1; SMN2HCRTR1TP53MAPTALOX15
SCHEMBL10692769 0.73 MAPK1 (0.39) SMN1; SMN2HCRTR1TP53MAPTALOX15
SCHEMBL10689387 0.73 SMN1; SMN2 (0.42) SMN1; SMN2HCRTR1TP53MAPTALOX15

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