SCHEMBL513072

SCHEMBL513072

C=C(C)C(=O)OC(O)CCOc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 4/20 0.45
MTNR1B P49286 4/20 0.45
TDP1 Q9NUW8 2/20 0.45
POLB P06746 1/20 0.45
APEX1 P27695 1/20 0.45
HTT P42858 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
HPGD P15428 1/20 0.44
RECQL P46063 1/20 0.42
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
PKM P14618 1/20 0.41
MAPK1 P28482 1/20 0.41
THRB P10828 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
LMNA P02545 1/20 0.40
ELANE P08246 1/20 0.40

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
SCHEMBL27716993 0.85 RAB9A (0.43) TDP1POLBAPEX1HTTMAPK1
SCHEMBL20483806 0.85 KDM4E (0.44) TDP1POLBAPEX1HTTLMNA
SCHEMBL27649362 0.82 ALDH1A1 (0.51) TDP1POLBAPEX1HTTL3MBTL1
SCHEMBL25261696 0.80 MAPK1 (0.51) HTTL3MBTL1HPGDMAPK1MAPT
SCHEMBL1415829 0.79 ABCB1 (0.48) HTTLMNAELANE
SCHEMBL6545250 0.79 ALDH1A1 (0.43) HTTHPGDELANE
SCHEMBL27230002 0.79 ALDH1A1 (0.40) TDP1HTTL3MBTL1MAPK1MAPT
SCHEMBL16610586 0.79 KDM4E (0.52) TDP1HPGD
SCHEMBL27990179 0.78 HPGD (0.50) POLBHTTL3MBTL1HPGDMAPK1
SCHEMBL1264240 0.78 MTNR1A (0.44) MTNR1AMTNR1BTDP1POLBAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1210381-A1 OPHTHALMIC AND OTORHINOLARYNGOLOGICAL DEVICE MATERIALS Alcon Universal, Ltd. (CH) 2002-06-05 EP claimed
WO-2001018079-A1 OPHTHALMIC AND OTORHINOLARYNGOLOGICAL DEVICE MATERIALS ALCON UNIVERSAL LTD. (CH) 2001-03-15 WO claimed
US-9957343-B2 Ionic bonding group-containing comb polymers BYK-CHEMIE, GMBH (DE) 2018-05-01 US disclosed
US-9556299-B2 Surface-active comb copolymers BYK-CHEMIE GMBH (DE) 2017-01-31 US disclosed
US-20150203619-A1 SURFACE-ACTIVE COMB COPOLYMERS BYK-CHEMIE GMBH (DE) 2015-07-23 US disclosed
US-20150152211-A1 IONIC BONDING GROUP-CONTAINING COMB POLYMERS BYK-CHEMIE GMBH (DE) 2015-06-04 US disclosed
US-8398235-B2 Plastic lens for spectacles, process for producing the same, and coating liquid applicator for use in the process HOYA CORPORATION (JP) 2013-03-19 US disclosed
US-20130018121-A1 COMPOSITION COMPRISING STABLE POLYOL MIXTURES BYK-CHEMIE GMBH (DE) 2013-01-17 US disclosed
US-20120029104-A1 COMPOSITION COMPRISING STABLE POLYOL MIXTURES BYK-CHEMIE GMBH (DE) 2012-02-02 US disclosed
US-20100014048-A1 PLASTIC LENS FOR SPECTACLES, PROCESS FOR PRODUCING THE SAME, AND COATING LIQUID APPLICATOR FOR USE IN THE PROCESS HOYA CORPORATION (JP) 2010-01-21 US disclosed
EP-2093605-A1 PLASTIC LENS FOR SPECTACLES, PROCESS FOR PRODUCING THE SAME, AND COATING LIQUID APPLICATOR FOR USE IN THE PROCESS HOYA CORPORATION (JP) 2009-08-26 EP disclosed
EP-1210381-A1 OPHTHALMIC AND OTORHINOLARYNGOLOGICAL DEVICE MATERIALS Alcon Universal, Ltd. (CH) 2002-06-05 EP disclosed
WO-2001018079-A1 OPHTHALMIC AND OTORHINOLARYNGOLOGICAL DEVICE MATERIALS ALCON UNIVERSAL LTD. (CH) 2001-03-15 WO disclosed
EP-0360617-A2 Dry toner, dry developer and process for forming images Hitachi Chemical Co., Ltd. (JP) 1990-03-28 EP disclosed