SCHEMBL27967488

SCHEMBL27967488

C=CC(=O)NC(C(C)(C)C)S(=O)(=O)O.[NaH]

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.47
CYP2C19 P33261 2/20 0.33
TGM2 P21980 1/20 0.32
ZDHHC20 Q5W0Z9 1/20 0.32
ZDHHC2 Q9UIJ5 1/20 0.32
ALDH1A1 P00352 2/20 0.31
MAPK1 P28482 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30

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
SCHEMBL1282258 0.98 TSHR (0.48) TSHRCYP2C19TGM2ZDHHC20ZDHHC2
SCHEMBL27967490 0.96 TSHR (0.47) TSHRCYP2C19TGM2ZDHHC20ZDHHC2
SCHEMBL27967321 0.96 TSHR (0.47) TSHRCYP2C19TGM2ZDHHC20ZDHHC2
SCHEMBL27998595 0.96 TSHR (0.47) TSHRCYP2C19TGM2ZDHHC20ZDHHC2
Ammonia Solution, Strong SCHEMBL27967316 0.96 TSHR (0.47) TSHRCYP2C19TGM2ZDHHC20ZDHHC2
SCHEMBL28324233 0.85 TSHR (0.47) TSHRCYP2C19TGM2ZDHHC20ZDHHC2
SCHEMBL27766988 0.80 TSHR (0.42) TSHRCYP2C19ZDHHC20ZDHHC2ALDH1A1
SCHEMBL28901879 0.79 TSHR (0.46) TSHRCYP2C19ZDHHC20ZDHHC2ALDH1A1
Acrylic Acid SCHEMBL8742887 0.76 TSHR (0.39) TSHRTGM2
SCHEMBL27481943 0.76 TSHR (0.56) TSHRCYP2C19TGM2ZDHHC20ZDHHC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106574099-B Hydrophilic material comprising sulfonic acid based copolymer and amino resins 三井化学株式会社 2019-06-21 CN disclosed
CN-109641432-A Antifogging laminate 三井化学株式会社 2019-04-16 CN disclosed
CN-109641431-A Antireflection laminated body 三井化学株式会社 2019-04-16 CN disclosed
CN-106574099-A Hydrophilic material comprising sulfonate copolymer and amino resin 三井化学株式会社 2017-04-19 CN disclosed
CN-105102498-B Copolymer and hydrophilic material comprising the same 三井化学株式会社 2017-04-12 CN disclosed
CN-103842401-B Compositions and the film formed by it 三井化学株式会社 2016-12-21 CN disclosed
CN-105073917-B The film formed by copolymer or compositions 三井化学株式会社 2016-11-02 CN disclosed
CN-105814092-A Composition for hydrophilic cured product 三井化学株式会社 2016-07-27 CN disclosed
CN-105102498-A Copolymer and hydrophilic material comprising the same MITSUI CHEMICALS INC 2015-11-25 CN disclosed
CN-105073917-A Film comprising copolymer or composition MITSU CHEMICALS INC 2015-11-18 CN disclosed
CN-103842401-A Composition and film comprising same MITSU CHEMICALS INC 2014-06-04 CN disclosed