SCHEMBL824529

SCHEMBL824529

CCCC(=O)Oc1c(C(C)c2cc(C(C)(C)CC)cc(C(C)(C)CC)c2O)cc(C(C)(C)CC)cc1C(C)(C)CC

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 5/20 0.35
PPARG P37231 5/20 0.35
RARG P13631 4/20 0.35
AKR1B1 P15121 3/20 0.34
ALOX15 P16050 1/20 0.33
RARA P10276 1/20 0.33
RARB P10826 1/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 1/20 0.33
VCAM1 P19320 7/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
LDHA P00338 1/20 0.31
LDHB P07195 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30

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
SCHEMBL13006767 0.91 RXRA (0.36) RXRAPPARGRARGAKR1B1ALOX15
SCHEMBL31063637 0.87 RXRA (0.39) RXRAPPARGRARGRARARARB
SCHEMBL12048413 0.85 RXRA (0.33) RXRAPPARGRARGRARARARB
SCHEMBL26602748 0.84 RXRA (0.35) RXRAPPARGRARGRARARARB
SCHEMBL29353638 0.83 RXRA (0.37) RXRAPPARGRARGRARARARB
SCHEMBL237192 0.83 RXRA (0.37) RXRAPPARGRARGRARARARB
SCHEMBL499773 0.83 RXRA (0.37) RXRAPPARGRARGRARARARB
SCHEMBL29464292 0.83 RXRA (0.37) RXRAPPARGRARGRARARARB
SCHEMBL30049255 0.83 RXRA (0.37) RXRAPPARGRARGRARARARB
SCHEMBL809525 0.81 CYP1A2 (0.41) RXRAPPARGRARGRARARARB

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-8142864-B2 Cellulose ester pellets, cellulose ester film, manufacturing method of cellulose ester film, polarizing plate, and liquid crystal display KONICA MINOLTA OPTO, INC. (JP) 2012-03-27 US disclosed
US-8142864-B2 Cellulose ester pellets, cellulose ester film, manufacturing method of cellulose ester film, polarizing plate, and liquid crystal display KONICA MINOLTA OPTO, INC. (JP) 2012-03-27 US disclosed
US-20100047480-A1 CELLULOSE ESTER PELLETS, CELLULOSE ESTER FILM, MANUFACTURING METHOD OF CELLULOSE ESTER FILM, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY C/O KONICA MINOLTA OPTO, INC. (JP) 2010-02-25 US disclosed
US-20100047480-A1 CELLULOSE ESTER PELLETS, CELLULOSE ESTER FILM, MANUFACTURING METHOD OF CELLULOSE ESTER FILM, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY C/O KONICA MINOLTA OPTO, INC. (JP) 2010-02-25 US disclosed