SCHEMBL8545991

SCHEMBL8545991

c1ccc(CN2CCN(c3nc4cccc5c4n3CCC5)CC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.50
ALDH1A1 P00352 2/20 0.50
MAPT P10636 2/20 0.50
KDM4E B2RXH2 1/20 0.50
HPGD P15428 1/20 0.50
ACHE P22303 1/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
HTR3E A5X5Y0 2/20 0.46
HTR3B O95264 2/20 0.46
HTR3A P46098 2/20 0.46
HTR3D Q70Z44 2/20 0.46
HTR3C Q8WXA8 2/20 0.46
HTR1A P08908 1/20 0.46
HTR2C P28335 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
NCF1 P14598 1/20 0.44
DRD4 P21917 2/20 0.43
CASP1 P29466 1/20 0.43

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
SCHEMBL8545734 0.88 CYP2C9 (0.47) HTR3AHTR1ACASP1CASP5DRD2
SCHEMBL8544059 0.84 MAPT (0.44) LMNAALDH1A1MAPTKDM4EHPGD
SCHEMBL8543289 0.81 NPC1 (0.45) MAPTNPC1RAB9AHTR3EHTR3B
SCHEMBL8548519 0.81 MAPT (0.47) ALDH1A1MAPTKDM4EHPGDACHE
Hydrochloric Acid SCHEMBL8550810 0.79 MAPT (0.46) ALDH1A1MAPTKDM4EHPGDACHE
SCHEMBL8542828 0.79 MAPT (0.42) LMNAALDH1A1MAPTKDM4EHPGD
SCHEMBL8548303 0.78 RAB9A (0.45) LMNAALDH1A1MAPTKDM4EHPGD
SCHEMBL8549930 0.78 MCL1 (0.46) LMNAALDH1A1MAPTKDM4EHPGD
SCHEMBL8545733 0.78 CYP2D6 (0.47) LMNAALDH1A1MAPTKDM4EHPGD
SCHEMBL2962557 0.77 HTR2C (0.44) ALDH1A1MAPTKDM4ENPC1RAB9A

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