SCHEMBL4985361

SCHEMBL4985361

CC1(C)CC(O)CC(C)(C)N1OCCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.41
ALDH1A1 P00352 2/20 0.37
EPHX2 P34913 1/20 0.37
GAA P10253 2/20 0.36
TSHR P16473 3/20 0.35
KMT2A Q03164 2/20 0.35
MGAM O43451 1/20 0.35
SI P14410 1/20 0.35
FUCA1 P04066 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 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
SCHEMBL5062027 0.84 ALDH1A1 (0.45) DHFRALDH1A1TSHRKMT2AKDM4E
SCHEMBL5080992 0.81 HRH3 (0.41) EPHX2GAAKMT2AKDM4EMEN1
SCHEMBL27875517 0.81 DHFR (0.44) DHFRALDH1A1
SCHEMBL27957814 0.80 TSHR (0.46) DHFRALDH1A1GAATSHRKMT2A
SCHEMBL4621770 0.80 DHFR (0.43) DHFRALDH1A1
SCHEMBL6435277 0.77 MEN1 (0.42) DHFRALDH1A1GAAKMT2AMEN1
SCHEMBL7743245 0.75 ALOX15 (0.41) GAAKMT2AMGAMSIKDM4E
SCHEMBL13008300 0.75 CYP2D6 (0.31) GAA
SCHEMBL9039403 0.75 CYP2D6 (0.31) GAA
SCHEMBL27490598 0.74 DHFR (0.32) DHFR

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
CN-103773388-A Liquid crystal medium, stabilizing method thereof and liquid crystal display MERCK PATENT GMBH 2014-05-07 CN disclosed
US-7388052-B2 Process for the preparation of block copolymers POLIMERI EUROPA S.P.A. (IT) 2008-06-17 US disclosed
CN-100379724-C Inhibition of pulp and paper yellowing using nitroxides and other coadditives CIBA SC HOLDING AG (CH) 2008-04-09 CN disclosed
EP-1519970-B1 PROCESS FOR THE PREPARATION OF BLOCK COPOLYMERS POLIMERI EUROPA SPA (IT) 2007-10-24 EP disclosed
US-20070219329-A1 polymerizing styrene using a nitroxy free radical catalyst, then adding methacrylonitrile; 2-methyl-2-(2,2,6,6-tetramethylpiperidin-1-yloxy)propionitrile catalyst; POLIMERI EUROPA S.P.A. (IT) 2007-09-20 US disclosed
EP-1519970-A1 PROCESS FOR THE PREPARATION OF BLOCK COPOLYMERS Polimeri Europa S.p.A. (IT) 2005-04-06 EP disclosed
WO-2004005361-A1 PROCESS FOR THE PREPARATION OF BLOCK COPOLYMERS POLIMERI EUROPA S.P.A. (IT) 2004-01-15 WO disclosed
CN-1270580-A Inhibition of pulp and paper yellowing using nitroxides and other coadditives CIBA SC HOLDING AG (CH) 2000-10-18 CN disclosed