SCHEMBL16664682

SCHEMBL16664682

COCC(C)OCCOCC(C)OC(=O)C1CCCCC1C(=O)OC(C)COC(C)COC(C)COC

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL9945511 0.92 TP53 (0.33)
SCHEMBL19386614 0.91 TDP1 (0.45) TDP1
SCHEMBL10040061 0.90 TDP1 (0.38) TDP1
SCHEMBL9945504 0.86 TDP1 (0.49) TDP1
SCHEMBL9945505 0.85 TDP1 (0.41) TDP1
SCHEMBL5513339 0.69 TP53 (0.39)
SCHEMBL17797266 0.69 TP53 (0.39)
SCHEMBL3290609 0.69 EPHX1 (0.40)
SCHEMBL3538870 0.69 TDP1 (0.35) TDP1
Acetic Acid SCHEMBL534937 0.68 TDP1 (0.40) TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9771466-B2 Glycol ether-based cyclohexanoate ester plasticizers and blends therefrom EXXONMOBIL CHEMICAL PATENTS INC. (US) 2017-09-26 US disclosed
US-20150112008-A1 Glycol Ether-Based Cyclohexanoate Ester Plasticizers and Blends Therefrom EXXONMOBIL CHEMICAL PATENTS INC. 2015-04-23 US disclosed