SCHEMBL8556154

SCHEMBL8556154

Oc1cccc2c1C(Cc1ccc(F)cc1)NCC2

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.48
DRD4 P21917 2/20 0.48
KDM1A O60341 2/20 0.48
ADRB2 P07550 1/20 0.48
SLC22A1 O15245 1/20 0.47
PRCP P42785 1/20 0.47
TBXA2R P21731 3/20 0.46
MEN1 O00255 1/20 0.45
ABL1 P00519 1/20 0.45
ALPL P05186 1/20 0.45
GAA P10253 1/20 0.45
KMT2A Q03164 1/20 0.45
RIN1 Q13671 1/20 0.45
OPRM1 P35372 1/20 0.42
OPRD1 P41143 1/20 0.42
OPRK1 P41145 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
PKM P14618 1/20 0.42

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
SCHEMBL8553841 0.83 KDM4E (0.50) ADRB2MEN1KMT2AKDM4EMAPT
SCHEMBL9411161 0.77 PRCP (0.77) DRD2DRD4KDM1AADRB2SLC22A1
SCHEMBL5691995 0.71 PRCP (0.63) KDM1AADRB2SLC22A1PRCP
SCHEMBL28308200 0.71 DRD3 (0.44) DRD2KDM1A
Bromide SCHEMBL9530444 0.71 OPRM1 (0.41) DRD2ADRB2OPRM1
SCHEMBL9126409 0.71 TBXA2R (0.64) ADRB2TBXA2ROPRM1KDM4EMAPT
SCHEMBL8552803 0.71 KDM1A (0.45) KDM1AMEN1KMT2AOPRM1OPRK1
SCHEMBL27959648 0.70 SLC22A1 (0.57) KDM1AADRB2SLC22A1PRCPOPRM1
SCHEMBL27644915 0.70 DRD3 (0.46) DRD2KDM1A
SCHEMBL10728169 0.69 PRCP (0.77) DRD2DRD4KDM1AADRB2SLC22A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0617022-B1 6,7, dialkoxy-3,4-dihydroisoquinolin-8-ol, process for preparation thereof and process for preparation of 6,7-dialkoxy-1,2,3,4-tetrahydroisoquinolin-8-ol using the compound BANYU PHARMA CO LTD (JP) 1998-02-11 EP disclosed