SCHEMBL6322725

SCHEMBL6322725

C=C(C)C(=O)OC(C)COc1ccc(C2(c3ccc(OCC(C)OC(=O)C(=C)C)c(CCC)c3)c3ccccc3-c3ccccc32)cc1CCC

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
PPARG P37231 3/20 0.31
PPARA Q07869 3/20 0.31
ALDH1A1 P00352 1/20 0.31
HIF1A Q16665 1/20 0.31
PDK2 Q15119 2/20 0.31
PPARD Q03181 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31

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
SCHEMBL4956470 0.93 ESR1 (0.35) ESR1ESR2ALDH1A1HIF1APDK2
SCHEMBL2234164 0.86 ESR1 (0.43) ESR1ESR2ALDH1A1PDK2PPARD
SCHEMBL6327945 0.85 ESR1 (0.39) ESR1ESR2PPARGPPARAALDH1A1
SCHEMBL2231416 0.84 PTGDR2 (0.37) ESR1ESR2ALDH1A1
SCHEMBL6324789 0.84 ESR1 (0.36) ESR1ESR2PPARGPPARAALDH1A1
SCHEMBL6321833 0.84 PPARG (0.36) ESR1ESR2PPARGPPARAPPARD
SCHEMBL23214383 0.83 ESR1 (0.36) ESR1ESR2PDK2
SCHEMBL6322728 0.82 PPARG (0.39) ESR1ESR2PPARGPPARAPPARD
SCHEMBL23214350 0.81 ESR1 (0.40) ESR1ESR2PPARGPPARAPDK2
SCHEMBL4136285 0.81 ESR1 (0.34) ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10611869-B2 Curable composition and cured product AGC Inc. (JP) 2020-04-07 US disclosed
US-20190218325-A1 CURABLE COMPOSITION AND CURED PRODUCT AGC Inc. (JP) 2019-07-18 US disclosed
US-20050185232-A1 Volume hologram recording photosensitive composition and its use NIPPON PAINT CO., LTD. (JP) 2005-08-25 US disclosed
US-20030096172-A1 Hologram recording material composition and hologram recording medium DAISO CO., LTD. (JP) 2003-05-22 US disclosed