SCHEMBL4386216

SCHEMBL4386216

CCCCOC(C)OC(=O)CC1CC2C=CC1C2

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.34
ALDH1A1 P00352 3/20 0.33
POLB P06746 1/20 0.32
ALOX15 P16050 1/20 0.32
EPHX2 P34913 2/20 0.32
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
MAPK1 P28482 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
SCHEMBL4379158 0.87 KDM4E (0.36) KDM4EALDH1A1POLBALOX15EPHX2
SCHEMBL22263800 0.81 KDM4E (0.38) KDM4EALDH1A1POLBALOX15EPHX2
SCHEMBL4377524 0.80 KDM4E (0.41) KDM4EALDH1A1POLBALOX15EPHX2
SCHEMBL4379193 0.80 ALDH1A1 (0.46) KDM4EALDH1A1POLBEPHX2MAPK1
SCHEMBL5368292 0.79 KDM4E (0.38) KDM4EALDH1A1
SCHEMBL22263786 0.78 NAAA (0.44) KDM4EALDH1A1EPHX2
SCHEMBL22263750 0.76 NAAA (0.46) KDM4EALDH1A1EPHX2
SCHEMBL22263863 0.76 NAAA (0.46) KDM4EALDH1A1EPHX2
SCHEMBL4379403 0.76 MIF (0.30)
SCHEMBL4739740 0.76 KDM4E (0.40) KDM4EALDH1A1POLBALOX15EPHX2

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-8211984-B2 Ring-opening metathesis polymer, hydrogenated product thereof, method for preparing the same, and use thereof MITSUI CHEMICALS, INC. (JP) 2012-07-03 US disclosed
US-20090215974-A1 RING-OPENING METATHESIS POLYMER, HYDROGENATED PRODUCT THEREOF, METHOD FOR PREPARING THE SAME, AND USE THEREOF MITSUI CHEMICALS INC (JP) 2009-08-27 US disclosed
EP-2045280-A1 RING-OPENING METATHESIS POLYMERS, PRODUCTS OF HYDROGENATION THEREOF, PROCESS FOR PRODUCTION OF THE SAME AND USES THEREOF Mitsui Chemicals, Inc. (JP) 2009-04-08 EP disclosed