SCHEMBL10692844

SCHEMBL10692844

Cc1nc2c3ccccc3ccn2c1CN1CCN(CCO)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.53
MAPT P10636 3/20 0.53
KMT2A Q03164 2/20 0.53
NPC1 O15118 1/20 0.52
ALDH1A1 P00352 3/20 0.48
MAPK1 P28482 2/20 0.48
LMNA P02545 1/20 0.48
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
RAB9A P51151 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
PKM P14618 1/20 0.43
GRM2 Q14416 1/20 0.41
MEN1 O00255 1/20 0.39
HTT P42858 1/20 0.38
POLB P06746 1/20 0.38
TSHR P16473 1/20 0.38
HTR2A P28223 2/20 0.38

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
SCHEMBL10694924 0.72 POLB (0.53) KDM4EMAPTKMT2ANPC1MAPK1
SCHEMBL10688636 0.72 MAPT (0.45) KDM4EMAPTKMT2ANPC1ALDH1A1
SCHEMBL10691659 0.71 MAPT (0.50) KDM4EMAPTKMT2ANPC1ALDH1A1
SCHEMBL12145159 0.71 MAPT (0.50) KDM4EMAPTKMT2ANPC1ALDH1A1
SCHEMBL10690155 0.71 ATP4A (0.55) KDM4EMAPTKMT2ANPC1ALDH1A1
SCHEMBL10688657 0.70 MAPT (0.46) KDM4EMAPTKMT2ANPC1ALDH1A1
SCHEMBL12145158 0.68 MAPT (0.55) KDM4EMAPTKMT2ANPC1ALDH1A1
SCHEMBL10689984 0.68 MAPT (0.44) KDM4EMAPTKMT2ANPC1ALDH1A1
SCHEMBL10694933 0.65 ADRA2A (0.50) KDM4EMAPTKMT2ANPC1ALDH1A1
SCHEMBL9283836 0.64 DRD2 (0.59) MAPTTSHRHTR2A

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