SCHEMBL6441709

SCHEMBL6441709

C=CC(=O)OSCCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.46
HCAR2 Q8TDS4 2/20 0.42
PTGS2 P35354 1/20 0.42
KEAP1 Q14145 1/20 0.41
AKR1B10 O60218 2/20 0.41
AKR1B1 P15121 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
CES1 P23141 1/20 0.39
MMP12 P39900 1/20 0.39
MMP13 P45452 1/20 0.39
ALDH1A1 P00352 2/20 0.39
HDAC3 O15379 1/20 0.39
MAPK1 P28482 1/20 0.39
ADRA1A P35348 1/20 0.39
HDAC4 P56524 1/20 0.39
SLC6A3 Q01959 1/20 0.39
HDAC1 Q13547 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39

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
SCHEMBL156938 0.84 THRB (0.44) THRBHCAR2AKR1B1TDP1CES1
SCHEMBL7212141 0.77 PTGS2 (0.53) PTGS2KEAP1TDP1CES1MMP12
SCHEMBL40718 0.75 THRB (0.67) THRBHCAR2PTGS2AKR1B10AKR1B1
SCHEMBL28722296 0.74 TDP1 (0.46) PTGS2KEAP1TDP1CES1MMP12
SCHEMBL7403225 0.74 KEAP1 (0.47) PTGS2KEAP1AKR1B1TDP1CES1
SCHEMBL6441713 0.73 NOS1 (0.48) PTGS2KEAP1TDP1CES1MMP12
SCHEMBL28157354 0.72 THRB (0.63) THRBHCAR2KEAP1AKR1B10AKR1B1
SCHEMBL146669 0.72 THRB (0.63) THRBHCAR2AKR1B10AKR1B1TDP1
SCHEMBL233782 0.72 THRB (0.50) THRBHCAR2PTGS2KEAP1AKR1B10
SCHEMBL28354511 0.72 THRB (0.50) THRBHCAR2PTGS2KEAP1AKR1B10

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 46 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1080381-B1 HIGH REFRACTIVE INDEX OPHTHALMIC DEVICE MATERIALS PREPARED USING A POST-POLYMERIZATION CROSS-LINKING METHOD ALCON MFG LTD (US) 2005-07-27 EP claimed
EP-1002244-B1 METHOD OF PREPARING FOLDABLE HIGH REFRACTIVE INDEX ACRYLIC OPHTHALMIC DEVICE MATERIALS ALCON LAB INC (US) 2003-02-26 EP claimed
EP-1079870-B1 BICOMPOSITE INTRAOCULAR LENS AND METHOD FOR ITS PREPARATION ALCON LAB INC (US) 2001-11-14 EP claimed
EP-1071482-B1 INTRAOCULAR LENS COATING COMPOSITIONS ALCON LAB INC (US) 2001-10-04 EP claimed
US-20010025086-A1 High refractive index ophthalmic device materials prepared using a post-polymerization cross-linking method NOVARTIS AG (CH) 2001-09-27 US claimed
US-6210438-B1 HAVING ANTERIOR SURFACE MATERIAL DIFFERENT FROM ARYL ACRYLIC HYDROPHOBIC COPOLYMER POSTERIOR SURFACE MATERIAL, FOR POSTERIOR CAPSULE OPACIFICATION RISK REDUCTION, A CROSS-LINKING AGENT, UV-ABSORBERS AND BLUE-LIGHT BLOCKING ALCON LABORATORIES, INC. 2001-04-03 US claimed
EP-1079870-A1 BICOMPOSITE INTRAOCULAR LENS AND METHOD FOR ITS PREPARATION Alcon Laboratories, Inc. (US) 2001-03-07 EP claimed
EP-1080381-A1 HIGH REFRACTIVE INDEX OPHTHALMIC DEVICE MATERIALS PREPARED USING A POST-POLYMERIZATION CROSS-LINKING METHOD ALCON LABORATORIES, INC. (US) 2001-03-07 EP claimed
US-6187042-B1 COMPRISING A SUBSTRATE AND A COATING FOR MAKING THE LENS MORE BIOCOMPATIBLE AND REDUCING THE RISK OF POSTERIOR CAPSULE OPACIFICATION, THE COATING IS BASED ON A POLYMER OF TWO HYDROPHOBIC ACRYLIC ESTERS CONTAINING A PHENYL GROUP ALCON LABORATORIES, INC. 2001-02-13 US claimed
EP-1071482-A1 INTRAOCULAR LENS COATING COMPOSITIONS Alcon Laboratories, Inc. (US) 2001-01-31 EP claimed
EP-1002244-A1 METHOD OF PREPARING FOLDABLE HIGH REFRACTIVE INDEX ACRYLIC OPHTHALMIC DEVICE MATERIALS ALCON LABORATORIES, INC. (US) 2000-05-24 EP claimed
WO-1999053348-A1 HIGH REFRACTIVE INDEX OPHTHALMIC DEVICE MATERIALS PREPARED USING A POST-POLYMERIZATION CROSS-LINKING METHOD ALCON LABORATORIES, INC. (US) 1999-10-21 WO claimed
WO-1999052570-A1 INTRAOCULAR LENS COATING COMPOSITIONS ALCON LABORATORIES, INC. (US) 1999-10-21 WO claimed
WO-1999052571-A1 BICOMPOSITE INTRAOCULAR LENS AND METHOD FOR ITS PREPARATION ALCON LABORATORIES, INC. (US) 1999-10-21 WO claimed
US-5891931-A CONTAINING A CURABLE ACRYLATED RESIN POLYMER ALCON LABORATORIES, INC. (US) 1999-04-06 US claimed
WO-1999008136-A1 METHOD OF PREPARING FOLDABLE HIGH REFRACTIVE INDEX ACRYLIC OPHTHALMIC DEVICE MATERIALS ALCON LABORATORIES, INC. (US) 1999-02-18 WO claimed
US-20220062169-A1 OCULAR LENS, PHARMACEUTICAL COMPOSITION, AND USES THEREOF GOLDRED NANOBIOTECH CO., LTD. (TW) 2022-03-03 US disclosed
WO-2020147830-A1 OCULAR LENS, PHARMACEUTICAL COMPOSITION, AND USES THEREOF GOLDRED NANOBIOTECH CO., LTD. (CN) 2020-07-23 WO disclosed
WO-1999008136-A1 METHOD OF PREPARING FOLDABLE HIGH REFRACTIVE INDEX ACRYLIC OPHTHALMIC DEVICE MATERIALS ALCON LABORATORIES, INC. (US) 1999-02-18 WO disclosed
WO-1999007756-A1 OPHTHALMIC LENS POLYMERS ALCON LABORATORIES, INC. (US) 1999-02-18 WO disclosed