SCHEMBL5599326

SCHEMBL5599326

C=C(C)C.CC(C)c1cccc(C(C)C)c1N1C(=O)C=CC1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 3/20 0.54
FAAH O00519 3/20 0.54
DPP4 P27487 5/20 0.48
ANPEP P15144 5/20 0.48
NR1H2 P55055 1/20 0.46
NR1H3 Q13133 1/20 0.46
GABRA1 P14867 2/20 0.39
GABRG2 P18507 2/20 0.39
GABRB3 P28472 2/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
GABRB1 P18505 1/20 0.39
PTGS1 P23219 1/20 0.39
SLC6A2 P23975 1/20 0.39
HTR2C P28335 1/20 0.39

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
SCHEMBL2032898 0.91 MGLL (0.63) MGLLFAAHDPP4ANPEPNR1H2
SCHEMBL3675670 0.81 MGLL (0.56) MGLLFAAHDPP4ANPEPNR1H2
SCHEMBL8010275 0.74 MGLL (0.47) MGLLFAAHDPP4ANPEPNR1H2
SCHEMBL2830698 0.74 MGLL (0.55) MGLLFAAHDPP4ANPEPGABRA1
SCHEMBL22863431 0.73 MGLL (0.46) MGLLFAAHDPP4ANPEPNR1H2
SCHEMBL29707903 0.71 MGLL (1.00) MGLLFAAHDPP4NR1H2NR1H3
SCHEMBL3482778 0.71 MGLL (1.00) MGLLFAAHDPP4NR1H2NR1H3
SCHEMBL8857930 0.71 DPP4 (0.51) MGLLFAAHDPP4ANPEPNR1H2
SCHEMBL28883442 0.70 MGLL (0.44) MGLLFAAHDPP4ANPEPNR1H2
SCHEMBL28883404 0.70 MGLL (0.44) MGLLFAAHDPP4ANPEPNR1H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1403297-B1 Transparent heat-resistant resin optical material and film TOSOH CORP (JP) 2007-03-28 EP disclosed
US-7001967-B2 Resin with excellent heat resistance and dynamic characteristics, having negative birefringence and exhibiting a high refractive index and a high Abbe number, especially optical compensating members such as films, sheets and TOSOH CORPORATION (JP) 2006-02-21 US disclosed
US-20040063887-A1 Transparent heat-resistant resin optical material and film TOSOH CORPORATION (JP) 2004-04-01 US disclosed
EP-1403297-A1 Transparent heat-resistant resin optical material and film Tosoh Corporation (JP) 2004-03-31 EP disclosed