SCHEMBL865557

SCHEMBL865557

O=C(O)C=Cc1ccc(OC(=O)c2ccc(OCCCC(F)(F)F)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 6/20 0.48
ABCG2 Q9UNQ0 2/20 0.48
CYP1A1 P04798 2/20 0.47
CYP1B1 Q16678 2/20 0.47
TBXAS1 P24557 2/20 0.45
SRD5A2 P31213 1/20 0.44
MAOB P27338 1/20 0.44
THRB P10828 1/20 0.43
ATM Q13315 1/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL2672553 1.00 PPARA (0.48) PPARAABCG2CYP1A1CYP1B1TBXAS1
SCHEMBL2672549 1.00 PPARA (0.48) PPARAABCG2CYP1A1CYP1B1TBXAS1
SCHEMBL21515068 1.00 PPARA (0.48) PPARAABCG2CYP1A1CYP1B1TBXAS1
SCHEMBL679336 1.00 PPARA (0.48) PPARAABCG2CYP1A1CYP1B1TBXAS1
SCHEMBL2672530 0.96 ABCG2 (0.47) PPARAABCG2CYP1A1CYP1B1TBXAS1
SCHEMBL2672531 0.96 ABCG2 (0.47) PPARAABCG2CYP1A1CYP1B1TBXAS1
SCHEMBL866113 0.96 ABCG2 (0.47) PPARAABCG2CYP1A1CYP1B1TBXAS1
SCHEMBL866112 0.96 ABCG2 (0.47) PPARAABCG2CYP1A1CYP1B1TBXAS1
SCHEMBL2671839 0.91 PPARA (0.46) PPARAABCG2CYP1A1CYP1B1TBXAS1
SCHEMBL864925 0.91 PPARA (0.46) PPARAABCG2CYP1A1CYP1B1TBXAS1

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170362381-A1 THERMALLY STABLE ALIGNMENT MATERIALS ROLIC AG (CH) 2017-12-21 US disclosed
EP-2222740-B1 FUNCTIONALIZED PHOTOREACTIVE COMPOUNDS ROLIC AG (CH) 2017-10-11 EP disclosed
US-9499649-B2 Functionalized photoreactive compounds ROLIC AG (CH) 2016-11-22 US disclosed
EP-1966119-B1 PHOTOCROSSLINKABLE MATERIALS ROLIC AG (CH) 2016-10-19 EP disclosed
WO-2016156079-A1 PHOTOALIGNMENT COMPOSITION ROLIC AG (CH) 2016-10-06 WO disclosed
EP-2739601-A1 PHOTOALIGNING MATERIAL Rolic AG (CH) 2014-06-11 EP disclosed
US-8557922-B2 Photocrosslinkable materials ROLIC AG (CH) 2013-10-15 US disclosed
WO-2013017467-A1 PHOTOALIGNING MATERIAL ROLIC AG (CH) 2013-02-07 WO disclosed
US-20130004679-A1 PHOTOCROSSLINKABLE MATERIALS ROLIC AG (CH) 2013-01-03 US disclosed
US-8329823-B2 Photocrosslinkable materials ROLIC AG (CH) 2012-12-11 US disclosed
EP-2142957-A1 METHOD OF UNIFORM AND DEFECT FREE LIQUID CRYSTAL ALIGNING LAYERS Rolic AG (CH) 2010-01-13 EP disclosed
WO-2009080147-A1 FUNCTIONALIZED PHOTOREACTIVE COMPOUNDS ROLIC AG (CH) 2009-07-02 WO disclosed
US-20080293888-A1 Photocrosslinkable Materials ROLIC AG (CH) 2008-11-27 US disclosed
WO-2008135131-A1 THERMALLY STABLE ALIGNMENT MATERIALS ROLIC AG (CH) 2008-11-13 WO disclosed
WO-2008119449-A1 METHOD OF UNIFORM AND DEFECT FREE LIQUID CRYSTAL ALIGNING LAYERS ROLIC AG (CH) 2008-10-09 WO disclosed
EP-1975687-A1 Method of uniform and defect free liquid crystal aligning layers Rolic AG (CH) 2008-10-01 EP disclosed
EP-1966119-A1 PHOTOCROSSLINKABLE MATERIALS Rolic AG (CH) 2008-09-10 EP disclosed
EP-1860094-A1 Photocrosslinkable materials Rolic AG (CH) 2007-11-28 EP disclosed
WO-2007071091-A1 PHOTOCROSSLINKABLE MATERIALS ROLIC AG (CH) 2007-06-28 WO disclosed
EP-1801097-A1 Photocrosslinkable materials Rolic AG (CH) 2007-06-27 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080293888-A1 Photocrosslinkable Materials DDC, PARG, ALAD PPARA 1787/4885ABCG2 4577/4885CYP1A1 3056/4885
US-20130004679-A1 PHOTOCROSSLINKABLE MATERIALS DDC, PARG, ALAD PPARA 1787/4885ABCG2 4577/4885CYP1A1 3056/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.