SCHEMBL6571613

SCHEMBL6571613

CC(C)C(=O)OOC(C)(C)C1CCCCC1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.32
SSTR4 P31391 1/20 0.31
SIGMAR1 Q99720 1/20 0.30
TSHR P16473 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
SCHEMBL2382305 0.85 ABCB1 (0.35) EPHX1SSTR4SIGMAR1TSHR
SCHEMBL9608671 0.83 ABCB1 (0.35) EPHX1SSTR4
SCHEMBL22418817 0.76 CA2 (0.47) TSHR
SCHEMBL9412070 0.75 MEN1 (0.31)
SCHEMBL14011269 0.75 ABCB1 (0.37)
SCHEMBL14094050 0.74 EPHX1 (0.33) EPHX1SSTR4SIGMAR1TSHR
SCHEMBL8427618 0.74 EPHX1 (0.33) EPHX1SSTR4
SCHEMBL26939357 0.74 CHRM2 (0.32) EPHX1SSTR4
SCHEMBL8427787 0.73
SCHEMBL11042839 0.73 EPHX1 (0.30) EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4164065-A None JP disclosed
EP-0478214-B2 Novel peroxy ester, and polymerization initiator and curing agent using the ester NIPPON OILS & FATS CO LTD (JP) 2004-04-14 EP disclosed
EP-0478214-B1 Novel peroxy ester, and polymerization initiator and curing agent using the ester NIPPON OILS & FATS CO LTD (JP) 1994-12-28 EP disclosed
JP-H04164065-A NEW ORGANIC PEROXIDE NIPPON OIL & FATS CO LTD 1992-06-09 JP disclosed
US-5117047-A Addition Polymerization Catalysts, Unsaturated Polyester Curing Agents NIPPON OIL & FATS COMPANY LIMITED (JP) 1992-05-26 US disclosed
EP-0478214-A2 Novel peroxy ester, and polymerization initiator and curing agent using the ester NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1992-04-01 EP disclosed