Bis(2-Ethylhexyl) Phthalate

Bis(2-Ethylhexyl) Phthalate

SCHEMBL8498138

CCCCC(CC)COC(=O)c1ccccc1C(=O)OCC(CC)CCCC.CCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCC

nearest known ligand 0.85

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Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 1/20 0.85
PRSS2 P07478 1/20 0.85
PRSS3 P35030 1/20 0.85
ALDH1A1 P00352 12/20 0.84
CYP3A4 P08684 5/20 0.84
CA2 P00918 1/20 0.84
LMNA P02545 5/20 0.72
TSHR P16473 7/20 0.71
MAPK1 P28482 4/20 0.68
TP53 P04637 1/20 0.68
L3MBTL1 Q9Y468 3/20 0.61
TDP1 Q9NUW8 3/20 0.61
HSD17B10 Q99714 3/20 0.59
KDM4E B2RXH2 2/20 0.59
POLB P06746 1/20 0.59
MAPT P10636 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
ATM Q13315 1/20 0.48

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
Bis(2-Ethylhexyl) Phthalate SCHEMBL9473452 1.00 PRSS1 (0.85) PRSS1PRSS2PRSS3ALDH1A1CYP3A4
SCHEMBL28117954 1.00 PRSS1 (0.85) PRSS1PRSS2PRSS3ALDH1A1CYP3A4
SCHEMBL27964979 1.00 PRSS1 (0.85) PRSS1PRSS2PRSS3ALDH1A1CYP3A4
SCHEMBL28117899 1.00 PRSS1 (0.85) PRSS1PRSS2PRSS3ALDH1A1CYP3A4
SCHEMBL29662788 1.00 PRSS1 (0.85) PRSS1PRSS2PRSS3ALDH1A1CYP3A4
SCHEMBL30801429 1.00 PRSS1 (0.85) PRSS1PRSS2PRSS3ALDH1A1CYP3A4
Bis(2-Ethylhexyl) Phthalate SCHEMBL6245567 1.00 PRSS1 (0.85) PRSS1PRSS2PRSS3ALDH1A1CYP3A4
SCHEMBL2351535 1.00 PRSS1 (0.85) PRSS1PRSS2PRSS3ALDH1A1CYP3A4
SCHEMBL2355245 0.99 ALDH1A1 (0.86) PRSS1PRSS2PRSS3ALDH1A1CYP3A4
Bis(2-Ethylhexyl) Phthalate SCHEMBL10614424 0.95 PRSS1 (0.77) PRSS1PRSS2PRSS3ALDH1A1CYP3A4

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
EP-0710573-B1 PRINTING PRESS PLATE, PROCESS FOR PRODUCING THE PLATE, AND METHOD OF PRINTING THEREWITH DAICEL CHEM (JP) 1999-03-17 EP disclosed
US-5780200-A PHOTOSENSITIVE BLEND CONTAINING CELLULOSE NITRATE, PHOTOABSORBER, AND LOW GLASS TRANSITION TEMPERATURE POLYURETHANE ELASTOMER COATED ONTO SUPPORT; DURABILITY DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1998-07-14 US disclosed
EP-0710573-A1 PRINTING PRESS PLATE, PROCESS FOR PRODUCING THE PLATE, AND METHOD OF PRINTING THEREWITH DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1996-05-08 EP disclosed