SCHEMBL8536653

SCHEMBL8536653

Cc1cc(NCCCN2CCN(C(c3ccccc3)c3ccc(Cl)cc3)CC2)c(O)c(C(C)(C)C)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 9/20 0.50
DRD2 P14416 8/20 0.50
HRH1 P35367 6/20 0.48
KCNH2 Q12809 4/20 0.48
OPRK1 P41145 3/20 0.48
HRH2 P25021 3/20 0.48
HTR2A P28223 3/20 0.48
HTR2B P41595 3/20 0.48
USP2 O75604 3/20 0.48
CHRM2 P08172 2/20 0.48
ADRA2A P08913 2/20 0.48
ADRA2C P18825 2/20 0.48
DRD4 P21917 2/20 0.48
ADRA1A P35348 2/20 0.48
ADORA3 P0DMS8 2/20 0.48
CNR1 P21554 2/20 0.48
GHSR Q92847 2/20 0.48
CYP2D6 P10635 2/20 0.48
LMNA P02545 2/20 0.48
ABCB11 O95342 1/20 0.48

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
SCHEMBL8540076 0.84 DRD3 (0.53) DRD3DRD2HRH1KCNH2OPRK1
SCHEMBL8537432 0.82 HRH1 (0.57) DRD3DRD2HRH1KCNH2OPRK1
SCHEMBL9423729 0.81 DRD3 (0.53) DRD3DRD2HRH1KCNH2OPRK1
SCHEMBL8536410 0.80 DRD3 (0.46) DRD3DRD2HRH1KCNH2OPRK1
SCHEMBL8537572 0.80 DRD3 (0.47) DRD3DRD2HRH1KCNH2OPRK1
SCHEMBL8537793 0.78 P2RX7 (0.53) DRD3DRD2HTR2A
SCHEMBL7283745 0.74 DRD3 (0.50) DRD3DRD2HRH1KCNH2OPRK1
SCHEMBL7670965 0.73 DRD3 (0.72) DRD3DRD2HRH1KCNH2OPRK1
SCHEMBL9702546 0.72 DRD3 (0.47) DRD3DRD2HRH1KCNH2OPRK1
SCHEMBL12223566 0.72 HRH3 (0.67) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0508334-B1 Novel aminophenol derivatives and pharmaceutical compositions thereof GREEN CROSS CORP (JP) 1998-01-07 EP claimed
US-5308840-A Antioxidants, antiallergens and antiinflammatory agents GREEN CROSS CORPORATION (JP) 1994-05-03 US claimed
EP-0508334-A2 Novel aminophenol derivatives and pharmaceutical compositions thereof THE GREEN CROSS CORPORATION (JP) 1992-10-14 EP claimed
EP-0508334-B1 Novel aminophenol derivatives and pharmaceutical compositions thereof GREEN CROSS CORP (JP) 1998-01-07 EP disclosed
US-5308840-A Antioxidants, antiallergens and antiinflammatory agents GREEN CROSS CORPORATION (JP) 1994-05-03 US disclosed
EP-0508334-A2 Novel aminophenol derivatives and pharmaceutical compositions thereof THE GREEN CROSS CORPORATION (JP) 1992-10-14 EP disclosed