SCHEMBL4419232

SCHEMBL4419232

CC1(C)CC(O)C(=O)C(C)(C)N1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.32
GAA P10253 1/20 0.32
ENO1 P06733 1/20 0.32
PTPN1 P18031 2/20 0.31
POLB P06746 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL3828997 0.74 SMN1; SMN2 (0.34) MAPK1ALDH1A1TSHRSMN1; SMN2
SCHEMBL3134455 0.72 MAPK1 (0.31) MAPK1ALDH1A1TSHR
Water SCHEMBL27965061 0.72
SCHEMBL27500143 0.71 TSHR (0.33) MAPK1TSHR
SCHEMBL15580399 0.71 ALDH1A1 (0.33) MAPK1ALDH1A1TSHR
SCHEMBL10591710 0.70 TP53 (0.31) GAA
SCHEMBL1661781 0.68 MAPK1 (0.34) MAPK1GAAPOLBALDH1A1TSHR
SCHEMBL11179820 0.64 ALPL (0.34) MAPK1ALDH1A1TSHR
SCHEMBL38638 0.63 RECQL (0.41) MAPK1GAAPOLBALDH1A1
Hno SCHEMBL8563343 0.62 RECQL (0.38) MAPK1GAAPOLBALDH1A1

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
EP-1440115-B1 CROSSLINKING OF UNSATURATED POLYESTERS BY THE USE OF HYDROXYLAMINE-ESTERS CIBA HOLDING INC (CH) 2009-08-05 EP disclosed
US-7465761-B2 Flame retardant composition with improved fluidity, flame retardant resin composition and molded products ADEKA CORPORATION (JP) 2008-12-16 US disclosed
EP-1978017-A1 NITROXYL COMPOUND, AND POLYMERIZATION INHIBITOR AND POLYMERIZATION INHIBITOR COMPOSITION USING SAME Adeka Corporation (JP) 2008-10-08 EP disclosed
EP-1719800-B1 FLAME RETARDANT COMPOSITION WITH ENHANCED FLUIDITY, FLAME RETARDANT RESIN COMPOSITION AND MOLDING THEREOF ADEKA CORP (JP) 2008-01-02 EP disclosed
US-20070176154-A1 Flame retardant composition with improved fluidity, flame retardant resin composition and molded products AKEKA CORPORATION (JP) 2007-08-02 US disclosed
EP-1719800-A1 FLAME RETARDANT COMPOSITION WITH ENHANCED FLUIDITY, FLAME RETARDANT RESIN COMPOSITION AND MOLDING THEREOF Asahi Denka Co., Ltd. (JP) 2006-11-08 EP disclosed
EP-1704133-A1 IMPROVED PROCESS FOR THE PRODUCTION AND PURIFICATION OF VI-NY L AROMATIC MONOMERS Polimeri Europa S.p.A. (IT) 2006-09-27 EP disclosed
WO-2005063659-A1 IMPROVED PROCESS FOR THE PRODUCTION AND PURIFICATION OF VI­NYL AROMATIC MONOMERS POLIMERI EUROPA S.P.A. (IT) 2005-07-14 WO disclosed