SCHEMBL18914482

SCHEMBL18914482

CC(O)c1ccc(Oc2cccc(Oc3cc4c(cc3Oc3cccc(Oc5ccc(C(C)O)cc5)c3C#N)C3(CC4(C)C)CC(C)(C)c4cc(Oc5cccc(Oc6ccc(C(C)O)cc6)c5C#N)c(Oc5cccc(Oc6ccc(C(C)O)cc6)c5C#N)cc43)c2C#N)cc1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
EZH2 Q15910 2/20 0.32
MAPT P10636 2/20 0.31
RXRA P19793 1/20 0.31
MCL1 Q07820 1/20 0.30
HPGD P15428 1/20 0.30
VEGFA P15692 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
SCHEMBL18914620 0.93 RXRA (0.34) POLBGAAMAPTRXRAMCL1
SCHEMBL18914622 0.92 UGT2B7 (0.36) EZH2
SCHEMBL18907160 0.86 RXRA (0.33) RXRA
SCHEMBL18907164 0.85 UGT2B7 (0.31)
SCHEMBL18914613 0.83 POLB (0.33) POLBGAAEZH2MAPT
SCHEMBL17430346 0.83 GAA (0.37) POLBGAAMAPTMCL1HPGD
SCHEMBL18914696 0.83 RXRA (0.40) POLBGAAEZH2MAPTRXRA
SCHEMBL18914619 0.83 SLC22A12 (0.36) POLBGAAEZH2MAPTRXRA
SCHEMBL18914477 0.83 EZH2 (0.35) POLBGAAEZH2MAPTRXRA
SCHEMBL20091581 0.82 EZH2 (0.31) EZH2MAPTMCL1

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-20180114698-A2 COMPOSITION FOR FILM FORMATION, FILM, PRODUCTION METHOD OF PATTERNED SUBSTRATE, AND COMPOUND JSR CORPORATION (JP) 2018-04-26 US disclosed
US-20170154782-A1 COMPOSITION FOR FILM FORMATION, FILM, PRODUCTION METHOD OF PATTERNED SUBSTRATE, AND COMPOUND JSR CORPORATION (JP) 2017-06-01 US disclosed