SCHEMBL8633294

SCHEMBL8633294

CC1(N2CCNCC2)CCCc2nc(O)ccc21

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
CRHBP P24387 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
CRHR2 Q13324 1/20 0.31

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
SCHEMBL16799145 0.74 TP53 (0.35) MEN1MAPTMAPK1KMT2A
SCHEMBL4203505 0.62 ADCY6 (0.43) HTR2AHTR2C
SCHEMBL31184295 0.59 ADRA2A (0.47) HTR2AHTR2CMAPT
SCHEMBL30946643 0.59 ADRA2A (0.52) HTR2AHTR2CTSHR
SCHEMBL23561744 0.58 PNMT (0.41) HTR2AHTR2C
SCHEMBL31621599 0.57 CYP3A4 (0.44) HTR2C
SCHEMBL21155902 0.57 CYP3A4 (0.44) HTR2C
SCHEMBL21041640 0.57 HTR2C (0.45) HTR2C
SCHEMBL13004986 0.56 CYP1A2 (0.35) TSHRMAPK1
SCHEMBL4950526 0.56 HTR3E (0.64) HTR2AHTR2CMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0489379-B1 5-amino-5,6,7,8-tetrahydroquinolines and related compounds, a process for their preparation and their use as medicaments HOECHST MARION ROUSSEL INC (US) 1998-07-15 EP disclosed
US-5310914-A Imination, reduction HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1994-05-10 US disclosed
US-5216164-A Used for relieving memory dysfunction such as Alzheimer's disease HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-06-01 US disclosed
EP-0489379-A1 5-amino-5,6,7,8-tetrahydroquinolines and related compounds, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-06-10 EP disclosed
US-5110815-A Alzheimer's disease HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1992-05-05 US disclosed