SCHEMBL4655434

SCHEMBL4655434

CC(C)(C)CC(C)(C)c1ccc(C(=O)c2ccc(O)cc2O)c(O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHBG P04278 2/20 0.54
HSP90AB1 P08238 1/20 0.46
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
USP2 O75604 2/20 0.45
GAA P10253 1/20 0.45
KEAP1 Q14145 1/20 0.45
NFE2L2 Q16236 1/20 0.45
CES2 O00748 1/20 0.44
CYP3A4 P08684 2/20 0.43
CYP2D6 P10635 1/20 0.43
HIF1A Q16665 1/20 0.43
CA12 O43570 4/20 0.43
CA1 P00915 4/20 0.43
CA2 P00918 4/20 0.43
CA7 P43166 4/20 0.43
CA9 Q16790 4/20 0.43
CA14 Q9ULX7 4/20 0.43
ALDH1A1 P00352 3/20 0.43
NPC1 O15118 2/20 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
SCHEMBL317178 0.83 SHBG (0.50) SHBGMEN1KMT2AUSP2GAA
SCHEMBL5479223 0.82 ALDH1A1 (0.52) HSP90AB1MEN1KMT2AUSP2GAA
SCHEMBL4655435 0.80 HTT (0.54) HSP90AB1HTTKDM4E
SCHEMBL4654422 0.79 NPC1 (0.51) HSP90AB1MEN1KMT2AUSP2GAA
SCHEMBL29357695 0.76 CES2 (0.73) SHBGHSP90AB1MEN1KMT2AUSP2
SCHEMBL39507 0.76 CES2 (0.73) SHBGHSP90AB1MEN1KMT2AUSP2
SCHEMBL340386 0.75 SHBG (0.61) SHBGMEN1KMT2AUSP2GAA
SCHEMBL68434 0.75 SHBG (0.61) SHBGMEN1KMT2AUSP2GAA
SCHEMBL28750425 0.75 TDP1 (0.59) HSP90AB1MEN1KMT2AGAACYP3A4
SCHEMBL29457570 0.75 SHBG (0.61) SHBGMEN1KMT2AUSP2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2746822-B1 PLASTIC LENS HOYA CORP (JP) 2016-01-20 EP disclosed
US-8895661-B2 Plastic lens HOYA CORPORATION (JP) 2014-11-25 US disclosed
EP-2746822-A1 PLASTIC LENS HOYA CORPORATION (JP) 2014-06-25 EP disclosed
EP-1505412-B1 Plastic lens and process for producing the lens HOYA CORP (JP) 2008-11-05 EP disclosed
US-20050046967-A1 Plastic lens and process for preparing the lens HOYA CORPORATION (JP) 2005-03-03 US disclosed
EP-1505412-A1 Plastic lens and process for producing the lens HOYA CORPORATION (JP) 2005-02-09 EP disclosed