SCHEMBL6905540

SCHEMBL6905540

C=CC(=O)OC(C)OC(C)Oc1ccc(C(C)(C)c2ccc(OC(C)OC(C)OC(=O)C=C)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.35
KDM4E B2RXH2 6/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
GAA P10253 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
THRB P10828 2/20 0.33
AR P10275 1/20 0.33
HTT P42858 4/20 0.33
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
NR1H4 Q96RI1 1/20 0.33
POLB P06746 1/20 0.32
HIF1A Q16665 2/20 0.31
PTPN5 P54829 1/20 0.31
TP53 P04637 2/20 0.31
MAPT P10636 2/20 0.31
HPGD P15428 2/20 0.31
TSHR P16473 2/20 0.31
CYP1A2 P05177 1/20 0.31
PPARG P37231 1/20 0.31

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
SCHEMBL21114313 0.99 ALDH1A1 (0.34) ALDH1A1KDM4ESMN1; SMN2GAATDP1
SCHEMBL12192011 0.95 KDM4E (0.42) ALDH1A1KDM4ESMN1; SMN2GAATDP1
SCHEMBL137573 0.93 ALDH1A1 (0.37) ALDH1A1KDM4ESMN1; SMN2GAATDP1
SCHEMBL21114342 0.89 THRB (0.42) ALDH1A1KDM4ESMN1; SMN2GAATDP1
SCHEMBL5899611 0.89 KMT2A (0.41) ALDH1A1KDM4ESMN1; SMN2GAAHTT
SCHEMBL5899438 0.88 TAS1R3 (0.40) ALDH1A1KDM4ESMN1; SMN2GAATDP1
SCHEMBL955583 0.88 KDM4E (0.44) ALDH1A1KDM4ESMN1; SMN2GAATDP1
SCHEMBL5899638 0.85 MAPT (0.38) ALDH1A1KDM4ESMN1; SMN2GAATDP1
SCHEMBL449798 0.82 THRB (0.43) ALDH1A1SMN1; SMN2GAATDP1THRB
SCHEMBL7631132 0.82 THRB (0.40) ALDH1A1KDM4ESMN1; SMN2GAATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5942303-A CURABLE ADDITION TERPOLYMER BASED ON 2,2-BIS(P-(METH)ACRYLOYL -(P-(METH)ACRYLOYLOXY(ALKYLOXY)N-PHENYL)PROPANES, WHERE N IS 2-5, AND UNSATURATED COMPOUND; IMPACT STRENGTH; LOW SPECIFIC GRAVITY; LIGHTWEIGHT; EYEGLASSES; CONTACT LENSES; LENSES NOF CORPORATION (JP) 1999-08-24 US claimed
US-12384870-B2 Method for setting polymerization condition and method for manufacturing optical material MITSUI CHEMICALS, INC. (JP) 2025-08-12 US disclosed
US-12252586-B2 Method for setting conditions for use of polymerization catalyst, polymerization condition setting method, and method for manufacturing optical material MITSUI CHEMICALS, INC. (JP) 2025-03-18 US disclosed
EP-3722840-B1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, AND MOLDED ARTICLE MITSUI CHEMICALS INC (JP) 2024-12-04 EP disclosed
EP-3521907-B1 PHOTOCHROMIC LENS AND POLYMERIZABLE COMPOSITION MITSUI CHEMICALS INC (JP) 2024-12-04 EP disclosed
US-20220372229-A1 METHOD FOR SETTING CONDITIONS FOR USE OF POLYMERIZATION CATALYST, POLYMERIZATION CONDITION SETTING METHOD, AND METHOD FOR MANUFACTURING OPTICAL MATERIAL MITSUI CHEMICALS, INC. (JP) 2022-11-24 US disclosed
EP-3988602-A1 USE CONDITION SETTING METHOD FOR POLYMERIZATION CATALYST, POLYMERIZATION CONDITION SETTING METHOD, AND METHOD FOR PRODUCING OPTICAL MATERIAL Mitsui Chemicals, Inc. (JP) 2022-04-27 EP disclosed
EP-3521322-B1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIALS, AND MOLDED BODY MITSUI CHEMICALS INC (JP) 2022-03-09 EP disclosed
US-11248077-B2 Polymerizable composition for optical material and molded product MITSUI CHEMICALS, INC. (JP) 2022-02-15 US disclosed
US-20210171682-A1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL AND MOLDED PRODUCT MITSUI CHEMICALS, INC. (JP) 2021-06-10 US disclosed
EP-0863128-B1 FLUORINATED POLYFUNCTIONAL (METH)ACRYLATE ESTERS, COMPOSITIONS, LOW-REFRACTION MATERIALS, AND ANTIREFLECTION FILMS NOF CORP (JP) 2001-11-21 EP disclosed
EP-0820980-B1 FLUORINATED POLYFUNCTIONAL (METH)ACRYLIC ESTERS, FLUOROMONOMER COMPOSITION, MATERIAL WITH LOW REFRACTIVE INDEX, AND LOWLY REFLECTIVE FILM NOF CORP (JP) 2001-07-11 EP disclosed
US-6254973-B1 WEAR RESISTANCE NOF CORPORATION (JP) 2001-07-03 US disclosed
US-6087010-A PROVIDES COMPOUNDS HAVING SUFFICIENTLY LOW REFRACTIVE INDEX, SUFFICIENTLY HIGH SURFACE HARDNESS, AND ADHESION NOF CORPORATION (JP) 2000-07-11 US disclosed
US-5942303-A CURABLE ADDITION TERPOLYMER BASED ON 2,2-BIS(P-(METH)ACRYLOYL -(P-(METH)ACRYLOYLOXY(ALKYLOXY)N-PHENYL)PROPANES, WHERE N IS 2-5, AND UNSATURATED COMPOUND; IMPACT STRENGTH; LOW SPECIFIC GRAVITY; LIGHTWEIGHT; EYEGLASSES; CONTACT LENSES; LENSES NOF CORPORATION (JP) 1999-08-24 US disclosed
EP-0863128-A1 FLUORINATED POLYFUNCTIONAL (METH)ACRYLATE ESTERS, COMPOSITIONS, LOW-REFRACTION MATERIALS, AND ANTIREFLECTION FILMS NOF CORPORATION (JP) 1998-09-09 EP disclosed
EP-0828167-A2 Resin composition for polymerization casting and optical material NOF CORPORATION (JP) 1998-03-11 EP disclosed
EP-0820980-A1 FLUORINATED POLYFUNCTIONAL (METH)ACRYLIC ESTERS, FLUOROMONOMER COMPOSITION, MATERIAL WITH LOW REFRACTIVE INDEX, AND LOWLY REFLECTIVE FILM NOF CORPORATION (JP) 1998-01-28 EP disclosed
EP-0751161-A2 Sulfur-containing urethane-based resin composition, optical element and lens comprising this resin MITSUI TOATSU CHEMICALS, Inc. (JP) 1997-01-02 EP disclosed
EP-0742244-A2 Durable polysulfide composition for optical material MITSUI TOATSU CHEMICALS, INC. (JP) 1996-11-13 EP disclosed