SCHEMBL2051041

SCHEMBL2051041

C=CCC1(CC=CCCCC)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.51
PKM P14618 1/20 0.51
LMNA P02545 4/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
HTT P42858 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 4/20 0.42
CYP2C19 P33261 2/20 0.42
ELANE P08246 3/20 0.41
CNR1 P21554 4/20 0.41
NPSR1 Q6W5P4 2/20 0.41
GPR55 Q9Y2T6 2/20 0.41
CYP3A4 P08684 2/20 0.35
RAB9A P51151 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
MAPK1 P28482 1/20 0.35
TP53 P04637 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
SCHEMBL2051040 1.00 KDM4E (0.51) KDM4EPKMLMNASMN1; SMN2HTT
SCHEMBL2050824 0.96 KDM4E (0.50) KDM4EPKMLMNASMN1; SMN2HTT
SCHEMBL2050826 0.96 KDM4E (0.50) KDM4EPKMLMNASMN1; SMN2HTT
SCHEMBL2048538 0.95 KDM4E (0.49) KDM4EPKMLMNASMN1; SMN2HTT
SCHEMBL2049075 0.95 KDM4E (0.49) KDM4EPKMLMNASMN1; SMN2HTT
SCHEMBL2051233 0.95 KDM4E (0.49) KDM4EPKMLMNASMN1; SMN2HTT
SCHEMBL2046891 0.95 KDM4E (0.49) KDM4EPKMLMNASMN1; SMN2HTT
SCHEMBL2046888 0.95 KDM4E (0.49) KDM4EPKMLMNASMN1; SMN2HTT
SCHEMBL2048535 0.95 KDM4E (0.49) KDM4EPKMLMNASMN1; SMN2HTT
SCHEMBL2049074 0.95 KDM4E (0.49) KDM4EPKMLMNASMN1; SMN2HTT

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 3 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
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