SCHEMBL14727461

SCHEMBL14727461

CCC(C)(C)C(=O)OCCCC(=O)CC(C)=O

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
KDM6B O15054 1/20 0.37
KDM5C P41229 1/20 0.37
EGLN1 Q9GZT9 1/20 0.37
PHF8 Q9UPP1 1/20 0.37
KDM2A Q9Y2K7 1/20 0.37
ALDH1A1 P00352 1/20 0.33
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
HAO1 Q9UJM8 1/20 0.33
HTR2C P28335 1/20 0.32
THRB P10828 1/20 0.30
PKM P14618 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
SCHEMBL14208827 0.90 KDM4E (0.39) KDM4EKDM6BKDM5CEGLN1PHF8
SCHEMBL14727465 0.85 RECQL (0.37) KDM4ECYP4F2CYP4A11HAO1HTR2C
SCHEMBL13667082 0.80 CYP4F2 (0.42) ALDH1A1CYP4F2CYP4A11
SCHEMBL19821844 0.79 TSHR (0.48) ALDH1A1CYP4F2CYP4A11
SCHEMBL2681601 0.79 AKR1B1 (0.40) ALDH1A1CYP4F2CYP4A11
SCHEMBL26363345 0.79 CYP4F2 (0.37) ALDH1A1CYP4F2CYP4A11HTR2C
SCHEMBL15450103 0.79 CYP4F2 (0.37) ALDH1A1CYP4F2CYP4A11
SCHEMBL19821918 0.79 KDM4E (0.34) KDM4EALDH1A1CYP4F2CYP4A11THRB
SCHEMBL17589169 0.78 ALDH1A1 (0.36) ALDH1A1CYP4F2CYP4A11
SCHEMBL19821859 0.78 EPHX1 (0.37) ALDH1A1CYP4F2CYP4A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130052584-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AND METHOD OF MANUFACTURING LITHOGRAPHIC PRINTING PLATE FUJIFILM CORPORATION (JP) 2013-02-28 US disclosed