M-Xylene

M-Xylene

SCHEMBL9352500

Cc1cccc(C)c1.N=C=S.N=C=S

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 6/20 0.67
ALDH1A1 P00352 2/20 0.46
MAPK1 P28482 1/20 0.46
TP53 P04637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CYP1A2 P05177 2/20 0.39
NPC1 O15118 1/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
MAPT P10636 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TSHR P16473 2/20 0.38
LMNA P02545 1/20 0.38

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
M-Xylene SCHEMBL18422142 1.00 ACHE (0.67) ACHEALDH1A1MAPK1TP53TDP1
M-Xylene SCHEMBL28007889 0.88 ACHE (0.75) ACHEALDH1A1MAPK1TP53TDP1
M-Xylene SCHEMBL28221118 0.85 ACHE (0.80) ACHEALDH1A1MAPK1TP53TDP1
M-Xylene SCHEMBL31383510 0.83 ACHE (0.67) ACHEALDH1A1MAPK1TP53TDP1
M-Xylene SCHEMBL27020 0.83 ACHE (0.67) ACHEALDH1A1MAPK1TP53TDP1
M-Xylene SCHEMBL163239 0.83 ACHE (0.67) ACHEALDH1A1MAPK1TP53TDP1
M-Xylene SCHEMBL28204206 0.83 ACHE (0.67) ACHEALDH1A1MAPK1TP53TDP1
M-Xylene SCHEMBL891494 0.82 ACHE (1.00) ACHEALDH1A1MAPK1TP53TDP1
M-Xylene SCHEMBL28189 0.82
M-Xylene SCHEMBL6397624 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11845828-B2 Polymerizable composition for optical material, optical material, and producing method thereof MITSUI CHEMICALS, INC. (JP) 2023-12-19 US disclosed
CN-111954832-A Photochromic optical article and method of making same 株式会社德山 2020-11-17 CN disclosed
EP-3135703-B1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, OPTICAL MATERIAL, AND METHOD FOR PRODUCING OPTICAL MATERIAL MITSUI CHEMICALS INC (JP) 2019-10-16 EP disclosed
EP-3533814-A1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, OPTICAL MATERIAL, AND PRODUCTION METHOD FOR OPTICAL MATERIAL Mitsui Chemicals, Inc. (JP) 2019-09-04 EP disclosed
US-20190248949-A1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, OPTICAL MATERIAL, AND PRODUCING METHOD THEREOF MITSUI CHEMICALS, INC. (JP) 2019-08-15 US disclosed
EP-3135703-A1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, OPTICAL MATERIAL, AND METHOD FOR PRODUCING OPTICAL MATERIAL Mitsui Chemicals, Inc. (JP) 2017-03-01 EP disclosed
US-20170029553-A1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIALS, OPTICAL MATERIAL, AND METHOD OF MANUFACTURING OPTICAL MATERIAL MITSUI CHEMICALS, INC. (JP) 2017-02-02 US disclosed
EP-0351073-B1 Lens comprising a resin having a large refractive index and process for preparing the lens MITSUI TOATSU CHEMICALS (JP) 1994-09-21 EP disclosed
US-5084545-A Polythiourethanes for impact strength, lightweight lenses MITSUI TOATSU CHEMICALS, INC. (JP) 1992-01-28 US disclosed
EP-0351073-A2 Lens comprising a resin having a large refractive index and process for preparing the lens MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-01-17 EP disclosed