SCHEMBL5387416

SCHEMBL5387416

CCCCCOC(N)C(C)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.45
SPHK1 Q9NYA1 3/20 0.42
HTT P42858 2/20 0.41
OPRM1 P35372 1/20 0.39
USP2 O75604 1/20 0.38
ALDH1A1 P00352 1/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
TP53 P04637 2/20 0.36
CYP2D6 P10635 2/20 0.35
GMNN O75496 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
THPO P40225 1/20 0.35
MTOR P42345 1/20 0.35
BLM P54132 1/20 0.35
KDM4E B2RXH2 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL27795023 0.98 DNM1 (0.48) DNM1SPHK1HTTOPRM1USP2
SCHEMBL27578847 0.98 DNM1 (0.48) DNM1SPHK1HTTOPRM1USP2
SCHEMBL9765642 0.93 SPHK1 (0.39) DNM1SPHK1HTTOPRM1ALDH1A1
SCHEMBL4395975 0.79 HTT (0.46) DNM1SPHK1HTTUSP2ALDH1A1
SCHEMBL11444946 0.78 SPHK1 (0.47) DNM1SPHK1HTTOPRM1USP2
SCHEMBL136729 0.78 DNM1 (0.50) DNM1SPHK1HTTOPRM1
SCHEMBL16553558 0.78 DNM1 (0.50) DNM1SPHK1HTTOPRM1
SCHEMBL9730272 0.77 DNM1 (0.43) DNM1SPHK1HTTUSP2ALDH1A1
SCHEMBL10379772 0.77 DNM1 (0.43) DNM1SPHK1HTTUSP2ALDH1A1
SCHEMBL9273623 0.77 DNM1 (0.48) DNM1SPHK1HTTOPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007029155-A2 AN IMPROVED PROCESS FOR PREPARATION OF PURE CELIPROLOL BASE RANBAXY LABORATORIES LIMITED (IN) 2007-03-15 WO disclosed
EP-0741705-A1 4-(2-(3-ARYLOXY-2-HYDROXYPROPYLAMINO ALKYLOXY)-5-NITROPHENYL)-1,4-DIHYDROPYRIDINES AS ANTIHYPERTENSIVE AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-11-13 EP disclosed
EP-0522176-A1 DIHYDROPYRIDINE COMPOUNDS, AND PROCESS FOR THEIR PREPARATION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-01-13 EP disclosed
WO-1992013839-A1 DIHYDROPYRIDINE COMPOUNDS, AND PROCESS FOR THEIR PREPARATION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-08-20 WO disclosed
EP-0194751-A1 Dihydropyridine alkanol amines, process for their preparation and pharmaceutical compositions containing them IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-09-17 EP disclosed
EP-0194752-A1 Dihydropyridine alkanol amines, process for their preparation and pharmaceutical compositions containing them IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-09-17 EP disclosed
EP-0194046-A1 Dihydropyridine alkanol amines, process for their preparation and pharmaceutical compositions containing them IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-09-10 EP disclosed
EP-0003664-A1 Alkanolamine derivatives, process for their preparation and pharmaceutical compositions containing them IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1979-08-22 EP disclosed