O-Xylene

O-Xylene

SCHEMBL28069090

C1CCNCC1.Cc1ccccc1C

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.53
ACHE P22303 1/20 0.53
HTR2C P28335 5/20 0.48
ADRB1 P08588 2/20 0.48
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.42
HTR7 P34969 1/20 0.42
OPRM1 P35372 1/20 0.40
HTR1A P08908 1/20 0.39
HTR3A P46098 1/20 0.39

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
O-Xylene SCHEMBL28188652 0.92 ACHE (0.62) TSHRACHEHTR2CADRB1ALDH1A1
O-Xylene SCHEMBL27991704 0.89 TSHR (0.59) TSHRACHEHTR2CADRB1ALDH1A1
O-Xylene SCHEMBL9614719 0.86 ACHE (0.62) TSHRACHEHTR2CADRB1ALDH1A1
O-Xylene SCHEMBL17698412 0.86 ACHE (0.62) TSHRACHEHTR2CADRB1ALDH1A1
Orthocresol SCHEMBL28200309 0.84 TRPA1 (0.41) TSHRACHEHTR2CADRB1ALDH1A1
O-Xylene SCHEMBL289634 0.83 TSHR (0.77) TSHRACHEALDH1A1LMNA
O-Tolylamine SCHEMBL29191361 0.83 CYP3A4 (0.64) TSHRACHEHTR2CADRB1ALDH1A1
Toluene SCHEMBL2949186 0.82 LMNA (0.55) TSHRACHEHTR2CADRB1ALDH1A1
Piperidine SCHEMBL27943254 0.81 CD44 (0.48) ACHEHTR2CADRB1ALDH1A1LMNA
Toluene SCHEMBL29087109 0.80 LMNA (0.52) TSHRACHEHTR2CADRB1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105765416-A Antiglare film 住友化学株式会社 2016-07-13 CN disclosed