P-Xylene

P-Xylene

SCHEMBL28101427

CCCCCN.Cc1ccc(C)cc1

nearest known ligand 0.60

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Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ DNM1 Q05193 8/20 0.60
▸ MEN1 O00255 1/20 0.60
▸ KMT2A Q03164 1/20 0.60
▸ ALDH1A1 P00352 1/20 0.60
▸ TSHR P16473 1/20 0.60
▸ EPHX1 P07099 1/20 0.60
▸ CYP1A2 P05177 1/20 0.48
▸ CYP2A6 P11509 1/20 0.48
▸ TAAR1 Q96RJ0 1/20 0.48
▸ HTT P42858 1/20 0.46
▸ HTR2A P28223 1/20 0.46
▸ KIF11 P52732 1/20 0.44
▸ TLR8 Q9NR97 3/20 0.42
▸ ACHE P22303 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.41

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
Dodecylamine SCHEMBL29115802 0.95 DNM1 (0.67) DNM1MEN1KMT2AALDH1A1TSHR
Dodecylamine SCHEMBL27445882 0.95 DNM1 (0.67) DNM1MEN1KMT2AALDH1A1TSHR
P-Xylene SCHEMBL11440480 0.95 DNM1 (0.62) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL4252547 0.89 DNM1 (0.48) DNM1MEN1KMT2AALDH1A1TSHR
Toluene SCHEMBL9480148 0.88 DNM1 (0.52) DNM1MEN1KMT2AALDH1A1TSHR
Toluene SCHEMBL28891446 0.86 DNM1 (0.56) DNM1MEN1KMT2AALDH1A1TSHR
Hexadecylamine SCHEMBL28056456 0.86 DNM1 (0.56) DNM1MEN1KMT2AALDH1A1TSHR
Dodecylamine SCHEMBL20338081 0.86 DNM1 (0.56) DNM1MEN1KMT2AALDH1A1TSHR
Toluene SCHEMBL20338086 0.86 DNM1 (0.56) DNM1MEN1KMT2AALDH1A1TSHR
Toluene SCHEMBL27260777 0.86 DNM1 (0.56) DNM1MEN1KMT2AALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108139668-A Photocurable coating composition for forming low refractive index layer 株式会社LG化学 2018-06-08 — — CN disclosed
CN-103782203-B Antireflection coating film 株式会社LG化学 2016-11-23 — — CN disclosed
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