SCHEMBL4654444

SCHEMBL4654444

CCCCCc1ccc(C(=O)c2ccc(O)cc2O)c(O)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.68
KDM4E B2RXH2 2/20 0.60
HTT P42858 2/20 0.59
KAT8 Q9H7Z6 2/20 0.56
ESR1 P03372 3/20 0.53
ADRA2A P08913 2/20 0.53
ADORA3 P0DMS8 2/20 0.53
TACR2 P21452 2/20 0.53
SLC6A2 P23975 2/20 0.53
SLC6A4 P31645 2/20 0.53
SLC6A3 Q01959 2/20 0.53
TP53 P04637 2/20 0.53
CYP3A4 P08684 2/20 0.53
SHBG P04278 2/20 0.53
ALDH1A1 P00352 2/20 0.53
LMNA P02545 2/20 0.53
HSPD1 P10809 1/20 0.53
ADRB3 P13945 1/20 0.53
HTR2C P28335 1/20 0.53
HSPE1 P61604 1/20 0.53

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
SCHEMBL4654508 0.98 PPARA (0.71) PPARAKDM4EHTTKAT8ESR1
SCHEMBL4655436 0.98 PPARA (0.71) PPARAKDM4EHTTKAT8ESR1
SCHEMBL4653153 0.98 PPARA (0.71) PPARAKDM4EHTTKAT8ESR1
SCHEMBL4654357 0.98 PPARA (0.71) PPARAKDM4EHTTKAT8ESR1
SCHEMBL4654500 0.98 PPARA (0.71) PPARAKDM4EHTTKAT8ESR1
SCHEMBL4654281 0.98 PPARA (0.71) PPARAKDM4EHTTKAT8ESR1
SCHEMBL4654279 0.98 PPARA (0.71) PPARAKDM4EHTTKAT8ESR1
SCHEMBL4653191 0.95 PPARA (0.61) PPARAKDM4EHTTKAT8ESR1
SCHEMBL29189686 0.92 PPARA (0.79) PPARAKDM4EKAT8ESR1ADRA2A
SCHEMBL5160191 0.92 PPARA (0.79) PPARAKDM4EKAT8ESR1ADRA2A

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