SCHEMBL2049685

SCHEMBL2049685

C=CCC1(CC=C)C(=O)NC(=O)N(C)C1=O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.41
GABRG2 P18507 3/20 0.41
GABRB3 P28472 3/20 0.41
GABRB2 P47870 2/20 0.41
ATM Q13315 1/20 0.41
LMNA P02545 3/20 0.37
KDM4E B2RXH2 1/20 0.34
MMP9 P14780 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CPT1A P50416 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
PGR P06401 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
SCHEMBL2046483 0.90 GABRA1 (0.37) GABRA1GABRG2GABRB3GABRB2ATM
SCHEMBL2046485 0.90 GABRA1 (0.37) GABRA1GABRG2GABRB3GABRB2ATM
SCHEMBL15974732 0.79 GABRA1 (0.40) GABRA1GABRG2GABRB3GABRB2ATM
SCHEMBL2046819 0.78 LMNA (0.41) LMNAKDM4EMMP9CPT1ASMN1; SMN2
SCHEMBL2047089 0.78 ALDH1A1 (0.40) GABRA1GABRG2GABRB3GABRB2ATM
SCHEMBL2046721 0.77 MMP9 (0.33) GABRA1GABRG2GABRB3GABRB2MMP9
Metharbital SCHEMBL78867 0.75 ATM (0.60) ATMLMNAMEN1KMT2ASMN1; SMN2
SCHEMBL25957 0.75 MMP9 (0.46) GABRA1GABRG2GABRB3GABRB2ATM
SCHEMBL10581828 0.74 CPT1A (0.31) ATMCPT1APGR
SCHEMBL27847405 0.74 KDM4E (0.39) GABRA1GABRG2GABRB3GABRB2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7964691-B2 5,5-diallyl-2,2-dimethyl-1,3-dioxane as monomer units; polymerization catalysts; heat resistance SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-06-21 US disclosed
WO-2009038031-A1 BLOCK COPOLYMER AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-03-26 WO disclosed
US-20080214755-A1 OLEFIN-DIENE COPOLYMER AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-04 US disclosed
US-20080214754-A1 DIENE POLYMER AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-04 US disclosed
CN-101255210-A Diene polymer and process for producing the same SUMITOMO CHEMICAL CO (JP) 2008-09-03 CN disclosed