SCHEMBL4982858

SCHEMBL4982858

CC(C)(ON1C(C)(C)CCCC1(C)C)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.44
ALDH1A1 P00352 2/20 0.41
ALOX15 P16050 1/20 0.41
CYP2B6 P20813 1/20 0.41
HSD11B1 P28845 1/20 0.35
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
OPRM1 P35372 3/20 0.32
CHRM2 P08172 2/20 0.32
CHRM1 P11229 2/20 0.32
KCNH2 Q12809 2/20 0.32
HTR1A P08908 1/20 0.32
ADRA2A P08913 1/20 0.32
DRD1 P21728 1/20 0.32
TBXA2R P21731 1/20 0.32
ACHE P22303 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32

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
SCHEMBL4986259 0.79 ALDH1A1 (0.42) MAPK1ALDH1A1ALOX15CYP2B6KMT2A
SCHEMBL13683794 0.79 CYP2B6 (0.35) MAPK1ALDH1A1CYP2B6HSD11B1MEN1
SCHEMBL12544321 0.73 TSHR (0.62) MAPK1ALDH1A1ALOX15MEN1KMT2A
SCHEMBL9794517 0.72 CETP (0.34) ALDH1A1SIGMAR1
SCHEMBL10464829 0.71 TSHR (0.67) ALDH1A1MEN1KMT2AGAACHRM2
SCHEMBL7473328 0.71
SCHEMBL6501299 0.71 CA4 (0.34) MAPK1CYP2B6OPRM1KCNH2SLC6A2
SCHEMBL12556878 0.70 TSHR (0.51) ALDH1A1ALOX15MEN1KMT2AGAA
SCHEMBL682099 0.69 CYP2D6 (0.36) ALDH1A1MEN1KMT2AOPRM1KCNH2
Cyclohexane SCHEMBL28002709 0.67 MAPK1 (0.77) MAPK1ALDH1A1ALOX15CYP2B6KMT2A

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
US-20100125122-A1 PROCESS FOR THE PRODUCTION OF A (CO)POLYMER COMPOSITION BY MEDIATED FREE RADICAL CHAIN GROWTH POLYMERIZATION DOW GLOBAL TECHNOLOGIES INC. 2010-05-20 US disclosed
US-7388052-B2 Process for the preparation of block copolymers POLIMERI EUROPA S.P.A. (IT) 2008-06-17 US 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