SCHEMBL14809587

SCHEMBL14809587

CCC(CCCCCCCCCCC(=O)OCC(C)C)CCC(=O)OCC(C)C.CCCCOC(=O)CCCCCCCCCCC(CC)CCC(=O)OCCCC

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.60
TSHR P16473 1/20 0.60
ATM Q13315 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
MAPT P10636 1/20 0.50
LMNA P02545 2/20 0.49
ALDH1A1 P00352 1/20 0.49
DGKA P23743 2/20 0.49
KDM4E B2RXH2 1/20 0.44
DUSP3 P51452 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
PRKCA P17252 1/20 0.43
PRKCE Q02156 1/20 0.43
PRKCQ Q04759 1/20 0.43
PRKCD Q05655 1/20 0.43
DNM1 Q05193 1/20 0.42
CA2 P00918 1/20 0.42
ENPP2 Q13822 1/20 0.41
LPAR1 Q92633 1/20 0.41

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
SCHEMBL494075 0.92 CYP3A4 (0.61) CYP3A4TSHRATMTDP1MAPT
SCHEMBL496102 0.92 CYP3A4 (0.61) CYP3A4TSHRATMTDP1MAPT
SCHEMBL495916 0.92 CYP3A4 (0.61) CYP3A4TSHRATMTDP1MAPT
SCHEMBL494023 0.92 CYP3A4 (0.61) CYP3A4TSHRATMTDP1MAPT
SCHEMBL494618 0.92 CYP3A4 (0.61) CYP3A4TSHRATMTDP1MAPT
SCHEMBL495539 0.92 CYP3A4 (0.61) CYP3A4TSHRATMTDP1MAPT
SCHEMBL495641 0.92 CYP3A4 (0.61) CYP3A4TSHRATMTDP1MAPT
SCHEMBL494389 0.92 CYP3A4 (0.61) CYP3A4TSHRATMTDP1MAPT
SCHEMBL495240 0.92 CYP3A4 (0.61) CYP3A4TSHRATMTDP1MAPT
SCHEMBL495980 0.92 CYP3A4 (0.61) CYP3A4TSHRATMTDP1MAPT

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
WO-2013042797-A1 PROCESS FOR PRODUCING SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-03-28 WO disclosed