SCHEMBL8613867

SCHEMBL8613867

OC(COc1ccccc1)CN1CCN(c2ccccc2)CC1

nearest known ligand 0.82

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.82
KMT2A Q03164 3/20 0.81
L3MBTL1 Q9Y468 2/20 0.81
MAPK1 P28482 2/20 0.81
ALDH1A1 P00352 1/20 0.77
LMNA P02545 1/20 0.77
HTR7 P34969 3/20 0.75
ALOX15 P16050 1/20 0.73
TDP1 Q9NUW8 1/20 0.73
KDM4E B2RXH2 1/20 0.73
CYP2D6 P10635 1/20 0.71
TSHR P16473 1/20 0.71
HIF1A Q16665 1/20 0.71
MEN1 O00255 2/20 0.69
ADRB2 P07550 1/20 0.69
ADRB1 P08588 1/20 0.69
ADRB3 P13945 1/20 0.69
GAA P10253 1/20 0.68

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
SCHEMBL8002897 0.92 MAPT (0.79) MAPTKMT2AL3MBTL1MAPK1ALDH1A1
SCHEMBL8009539 0.92 MAPT (0.79) MAPTKMT2AL3MBTL1MAPK1ALDH1A1
SCHEMBL25097473 0.92 MAPT (0.79) MAPTKMT2AL3MBTL1MAPK1ALDH1A1
SCHEMBL3970369 0.91 L3MBTL1 (0.97) MAPTKMT2AL3MBTL1ALDH1A1KDM4E
SCHEMBL4577971 0.91 L3MBTL1 (0.97) MAPTKMT2AL3MBTL1ALDH1A1KDM4E
SCHEMBL11240406 0.91 L3MBTL1 (0.97) MAPTKMT2AL3MBTL1ALDH1A1KDM4E
SCHEMBL12577217 0.91 MAPT (1.00) MAPTKMT2AL3MBTL1MAPK1ALDH1A1
SCHEMBL12575381 0.91 MAPT (1.00) MAPTKMT2AL3MBTL1MAPK1ALDH1A1
SCHEMBL12259197 0.90 MAPT (0.76) MAPTKMT2AL3MBTL1MAPK1ALDH1A1
SCHEMBL28632862 0.90 MAPK1 (0.91) MAPTKMT2AL3MBTL1MAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0089634-B1 PHENOXYPROPANOLAMINE DERIVATIVES NIPPON SHINYAKU COMPANY, LIMITED (JP) 1986-07-02 EP claimed
EP-0089634-A1 Phenoxypropanolamine derivatives NIPPON SHINYAKU COMPANY, LIMITED (JP) 1983-09-28 EP claimed
JP-58164583-A None JP disclosed
EP-0833639-A1 PHENOXY PIPERAZINE DERIVATIVES FOR TREATING DISORDERS OF THE DOPAMINE SYSTEM F. HOFFMANN-LA ROCHE AG (CH) 1998-04-08 EP disclosed
US-5614526-A IN TREATING DISORDERS OF THE DOPAMINE SYSTEM HOFFMANN-LA ROCHE INC. (US) 1997-03-25 US disclosed
WO-1996041630-A1 PHENOXY PIPERAZINE DERIVATIVES FOR TREATING DISORDERS OF THE DOPAMINE SYSTEM F. HOFFMANN-LA ROCHE AG (CH) 1996-12-27 WO disclosed
US-4642307-A HYPOTENSIVE AGENTS NIPPON SHINYAKU CO., LTD. (JP) 1987-02-10 US disclosed
US-4642307-A HYPOTENSIVE AGENTS NIPPON SHINYAKU CO., LTD. (JP) 1987-02-10 US disclosed
EP-0089634-B1 PHENOXYPROPANOLAMINE DERIVATIVES NIPPON SHINYAKU COMPANY, LIMITED (JP) 1986-07-02 EP disclosed
JP-S58164583-A PHENOXYPROPANOLAMINE DERIVATIVE NIPPON SHINYAKU CO LTD 1983-09-29 JP disclosed
EP-0089634-A1 Phenoxypropanolamine derivatives NIPPON SHINYAKU COMPANY, LIMITED (JP) 1983-09-28 EP disclosed
EP-0089634-A1 Phenoxypropanolamine derivatives NIPPON SHINYAKU COMPANY, LIMITED (JP) 1983-09-28 EP disclosed
US-3951983-A HYPOTENSIVE PFIZER INC. (US) 1976-04-20 US disclosed
US-3930004-A Method of using phenoxypropanolpiperazine compounds to lower blood pressure PFIZER 1975-12-30 US disclosed
US-3856794-A 1-PHENOXY-3-ARYLPIPERAZINYL-2-PROPANOL HYPOTENSIVES UNITED STIRLING AB., A CORP. OF SWEDEN (SE) 1974-12-24 US disclosed