SCHEMBL14647472

SCHEMBL14647472

C=COCC(O)CNCC(O)COC=C

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
ADRB2 P07550 6/20 0.33
ALDH1A1 P00352 1/20 0.33
ACHE P22303 1/20 0.32
HTR1A P08908 2/20 0.31
ADRB1 P08588 3/20 0.31
CYP2D6 P10635 2/20 0.31
LMNA P02545 1/20 0.31
ADRB3 P13945 1/20 0.31
ADRA2C P18825 1/20 0.31
SLC6A2 P23975 1/20 0.31
BDKRB2 P30411 1/20 0.31
SLC6A4 P31645 1/20 0.31
ADRA1A P35348 1/20 0.31
HTR2B P41595 1/20 0.31
KCNH2 Q12809 1/20 0.31
CYP1A2 P05177 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31

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
SCHEMBL10049656 0.87 KDM4E (0.61) KDM4EACHECYP2D6
SCHEMBL2965228 0.82 CA1 (0.36)
SCHEMBL690204 0.75
SCHEMBL12516727 0.73
SCHEMBL9818645 0.73
SCHEMBL15721376 0.73
SCHEMBL14647473 0.73
SCHEMBL9861979 0.73
SCHEMBL657914 0.73
SCHEMBL2400387 0.73 CA1 (0.61) KDM4EADRB2ALDH1A1ACHEHTR1A

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-9371408-B2 Polymer and method for using the same GENERAL ELECTRIC COMPANY (US) 2016-06-21 US disclosed
US-9371408-B2 Polymer and method for using the same GENERAL ELECTRIC COMPANY (US) 2016-06-21 US disclosed
US-20140179854-A1 POLYMER AND METHOD FOR USING THE SAME GENERAL ELECTRIC COMPANY (US) 2014-06-26 US disclosed
US-20140179854-A1 POLYMER AND METHOD FOR USING THE SAME GENERAL ELECTRIC COMPANY (US) 2014-06-26 US disclosed
WO-2013009594-A2 POLYMER AND METHOD FOR USING THE SAME GENERAL ELECTRIC COMPANY (US) 2013-01-17 WO disclosed