SCHEMBL21114342

SCHEMBL21114342

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

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.42
ALDH1A1 P00352 5/20 0.35
KDM4E B2RXH2 5/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
GAA P10253 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
MAPT P10636 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
AR P10275 1/20 0.33
HTT P42858 4/20 0.33
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
NR1H4 Q96RI1 1/20 0.33
ELANE P08246 2/20 0.32
POLB P06746 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 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
SCHEMBL137573 0.96 ALDH1A1 (0.37) THRBALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL5899638 0.93 MAPT (0.38) THRBALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL5899611 0.92 KMT2A (0.41) ALDH1A1KDM4ESMN1; SMN2GAAMAPT
SCHEMBL955583 0.90 KDM4E (0.44) ALDH1A1KDM4ESMN1; SMN2GAATDP1
SCHEMBL21114313 0.90 ALDH1A1 (0.34) THRBALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL5899438 0.90 TAS1R3 (0.40) ALDH1A1KDM4ESMN1; SMN2GAATDP1
SCHEMBL10870942 0.90 THRB (0.50) THRBALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL6905540 0.89 ALDH1A1 (0.35) THRBALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL5899761 0.87 THRB (0.45) THRBALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL2584694 0.85 THRB (0.54) THRBALDH1A1KDM4ESMN1; SMN2GAA

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
US-12384870-B2 Method for setting polymerization condition and method for manufacturing optical material MITSUI CHEMICALS, INC. (JP) 2025-08-12 US disclosed
EP-3521907-B1 PHOTOCHROMIC LENS AND POLYMERIZABLE COMPOSITION MITSUI CHEMICALS INC (JP) 2024-12-04 EP disclosed
EP-3722840-B1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, AND MOLDED ARTICLE MITSUI CHEMICALS INC (JP) 2024-12-04 EP 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
US-20210079151-A1 METHOD FOR SETTING POLYMERIZATION CONDITION AND METHOD FOR MANUFACTURING OPTICAL MATERIAL MITSUI CHEMICALS, INC. (JP) 2021-03-18 US disclosed
US-20210054126-A1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL AND MOLDED PRODUCT MITSUI CHEMICALS, INC. (JP) 2021-02-25 US disclosed
EP-3778655-A1 METHOD FOR SETTING POLYMERIZATION CONDITIONS AND METHOD FOR PRODUCING OPTICAL MATERIAL Mitsui Chemicals, Inc. (JP) 2021-02-17 EP disclosed
EP-3722840-A1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, AND MOLDED ARTICLE Mitsui Chemicals, Inc. (JP) 2020-10-14 EP disclosed
EP-3521907-A1 PHOTOCHROMIC LENS AND POLYMERIZABLE COMPOSITION Mitsui Chemicals, Inc. (JP) 2019-08-07 EP disclosed
EP-3521322-A1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIALS, AND MOLDED BODY Mitsui Chemicals, Inc. (JP) 2019-08-07 EP disclosed
US-20190211258-A1 PHOTOCHROMIC LENS AND POLYMERIZABLE COMPOSITION MITSUI CHEMICALS, INC. (JP) 2019-07-11 US disclosed