SCHEMBL4654435

SCHEMBL4654435

CCCc1ccc(C(=O)c2ccc(O)cc2O)c(O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 1/20 0.54
KDM4E B2RXH2 1/20 0.53
PPARA Q07869 1/20 0.53
ESR1 P03372 1/20 0.51
SHBG P04278 1/20 0.51
ESR2 Q92731 1/20 0.51
HTT P42858 2/20 0.51
CA12 O43570 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA7 P43166 2/20 0.50
CA9 Q16790 2/20 0.50
CA14 Q9ULX7 2/20 0.50
ALOX15 P16050 1/20 0.50
NPC1 O15118 5/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
RAB9A P51151 4/20 0.49
MAPT P10636 3/20 0.49
CASP3 P42574 1/20 0.49
SENP8 Q96LD8 1/20 0.49

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
SCHEMBL4653191 0.90 PPARA (0.61) HSP90AB1KDM4EPPARAESR1SHBG
SCHEMBL4654444 0.89 PPARA (0.68) HSP90AB1KDM4EPPARAESR1SHBG
SCHEMBL4654281 0.88 PPARA (0.71) HSP90AB1KDM4EPPARAESR1SHBG
SCHEMBL4654357 0.88 PPARA (0.71) HSP90AB1KDM4EPPARAESR1SHBG
SCHEMBL4654500 0.88 PPARA (0.71) HSP90AB1KDM4EPPARAESR1SHBG
SCHEMBL4654279 0.88 PPARA (0.71) HSP90AB1KDM4EPPARAESR1SHBG
SCHEMBL4654508 0.88 PPARA (0.71) HSP90AB1KDM4EPPARAESR1SHBG
SCHEMBL4655436 0.88 PPARA (0.71) HSP90AB1KDM4EPPARAESR1SHBG
SCHEMBL4653153 0.88 PPARA (0.71) HSP90AB1KDM4EPPARAESR1SHBG
SCHEMBL5709868 0.87 KMT2A (0.59) HSP90AB1KDM4EESR1SHBGESR2

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 7 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-20070141355-A1 Plastic lens and process for preparing the lens HOYA CORPORATION 2007-06-21 US 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