SCHEMBL8166646

SCHEMBL8166646

CC#CCCOC(=O)/C=C\C(=O)OCCC#CC

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.48
HCAR2 Q8TDS4 7/20 0.45
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
ALOX5 P09917 1/20 0.33
TSHR P16473 5/20 0.32
HPGD P15428 1/20 0.32
ALDH1A1 P00352 3/20 0.31
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31
CYP3A4 P08684 1/20 0.31
HSD17B10 Q99714 1/20 0.31
APP P05067 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
SCHEMBL8166653 1.00 ATM (0.48) ATMHCAR2MAPTRAB9ANPSR1
SCHEMBL7645953 0.79 ALDH1A1 (0.38) ALDH1A1
SCHEMBL16648784 0.79 THRB (0.30)
SCHEMBL9067562 0.78 ATM (0.39) ATMHCAR2MAPTRAB9ANPSR1
SCHEMBL27943807 0.77
SCHEMBL7645955 0.77
SCHEMBL15066950 0.76
SCHEMBL12284482 0.76 ADRA2A (0.46) MAPTTSHRCYP3A4
SCHEMBL11576466 0.74 CHRNB2 (0.31)
SCHEMBL28041775 0.74 CYP1A2 (0.33) CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6034199-A USING ACETYLENIC DIESTER AS POLYMERIZATION INHIBITOR GENERAL ELECTRIC COMPANY (US) 2000-03-07 US disclosed
US-6015853-A STABILIZING POLYSILOXANE WITH ACETYLENIC MALEATE DERIVATIVE GENERAL ELECTRIC COMPANY (US) 2000-01-18 US disclosed
US-6002039-A Liquid injection molding inhibitors for curable compositions GENERAL ELECTRIC COMPANY (US) 1999-12-14 US disclosed
US-5948339-A Method of producing articles using new liquid injection molding inhibitors for curable compositions GENERAL ELECTRIC COMPANY (US) 1999-09-07 US disclosed
US-5928564-A Liquid injection molding inhibitors for curable compositions GENERAL ELECTRIC COMPANY (US) 1999-07-27 US disclosed
US-5922795-A Liquid injection molding inhibitors for curable compositions GENERAL ELECTRIC COMPANY (US) 1999-07-13 US disclosed
US-5506289-A ACETYLENIC MALEATES AND FUMARATES AND DERIVATIVES AS POLYSILOXANE CURING INHIBITORS, CREATING NEW COMPOSITIONS OF HIGH HARDNESS AND TEAR STRENGTH MOMENTIVE PERFORMANCE MATERIALS INC. 1996-04-09 US disclosed