SCHEMBL8544700

SCHEMBL8544700

c1cc2c3c(c1)nc(N1CCOCC1)n3CCC2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
POLB P06746 1/20 0.43
KDM4E B2RXH2 7/20 0.41
ALDH1A1 P00352 5/20 0.39
TSHR P16473 2/20 0.39
HPGD P15428 3/20 0.39
HSD17B10 Q99714 3/20 0.39
GLA P06280 2/20 0.39
GAA P10253 2/20 0.39
ELANE P08246 1/20 0.38
MCL1 Q07820 1/20 0.38
TP53 P04637 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CASP1 P29466 1/20 0.37
PIK3CA P42336 1/20 0.36
MEN1 O00255 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL8548519 0.87 MAPT (0.47) MAPTNPC1RAB9AKDM4EALDH1A1
Hydrochloric Acid SCHEMBL8550810 0.86 MAPT (0.46) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL8544059 0.85 MAPT (0.44) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL8543289 0.84 NPC1 (0.45) MAPTNPC1RAB9A
SCHEMBL8548303 0.84 RAB9A (0.45) MAPTNPC1RAB9APOLBKDM4E
SCHEMBL2962557 0.83 HTR2C (0.44) MAPTNPC1RAB9AKDM4EALDH1A1
Hydrochloric Acid SCHEMBL8549627 0.83 RAB9A (0.44) MAPTNPC1RAB9APOLBKDM4E
Hydrochloric Acid SCHEMBL8544100 0.82 CDK8 (0.45) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL8542828 0.80 MAPT (0.42) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL8549930 0.79 MCL1 (0.46) MAPTNPC1RAB9APOLBKDM4E

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0700913-B1 5,6-dihydro-4H-imidazo(4,5,1-ij)quinolines, processes for their preparation, their use as medicaments, and intermediate compounds HOECHST MARION ROUSSEL INC (US) 1998-06-03 EP claimed
US-5500423-A ANALGESICS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1996-03-19 US claimed
EP-0700913-A1 5,6-dihydro-4H-imidazo(4,5,1-ij)quinolines, processes for their preparation, their use as medicaments, and intermediate compounds HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1996-03-13 EP claimed
EP-0700913-B1 5,6-dihydro-4H-imidazo(4,5,1-ij)quinolines, processes for their preparation, their use as medicaments, and intermediate compounds HOECHST MARION ROUSSEL INC (US) 1998-06-03 EP disclosed
US-5563272-A ANALGESICS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1996-10-08 US disclosed
US-5500423-A ANALGESICS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1996-03-19 US disclosed
EP-0700913-A1 5,6-dihydro-4H-imidazo(4,5,1-ij)quinolines, processes for their preparation, their use as medicaments, and intermediate compounds HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1996-03-13 EP disclosed