O-Xylene

O-Xylene

SCHEMBL28078166

CN1CCNCC1.Cc1ccccc1C

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 5/20 0.59
HTR7 P34969 4/20 0.52
LMNA P02545 1/20 0.52
HTR3A P46098 6/20 0.47
HTR1A P08908 6/20 0.47
TSHR P16473 1/20 0.46
ACHE P22303 1/20 0.46
HTR3E A5X5Y0 1/20 0.45
HTR3B O95264 1/20 0.45
HTR3D Q70Z44 1/20 0.45
HTR3C Q8WXA8 1/20 0.45
SIGMAR1 Q99720 1/20 0.45
HTR2C P28335 3/20 0.44
CYP1A2 P05177 3/20 0.44
CYP3A4 P08684 3/20 0.44
CYP2D6 P10635 3/20 0.44
CYP2C9 P11712 3/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 1/20 0.44
HTR2A P28223 1/20 0.42

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
Methylpiperazine SCHEMBL27759929 0.84 ADRB1 (0.50) ADRB1HTR7LMNAHTR3AHTR1A
Biphenyl SCHEMBL10725648 0.82 HTR1A (0.53) ADRB1HTR7HTR3AHTR1ATSHR
1,2-Dichlorobenzene SCHEMBL27980811 0.80 ADRB1 (0.59) ADRB1HTR7LMNAHTR3AHTR1A
O-Xylene SCHEMBL9614719 0.80 ACHE (0.62) ADRB1HTR7LMNAHTR3AHTR1A
O-Xylene SCHEMBL17698412 0.80 ACHE (0.62) ADRB1HTR7LMNAHTR3AHTR1A
Methylpiperazine SCHEMBL28182481 0.80 ADRB1 (0.44) ADRB1HTR7HTR3AHTR1AHTR3E
Methylpiperazine SCHEMBL27548472 0.79 ADRB1 (0.46) ADRB1HTR7LMNAHTR3AHTR1A
Methylpiperazine SCHEMBL27594948 0.78 SIGMAR1 (0.47) ADRB1HTR7HTR3AHTR1AHTR3E
Methylpiperazine SCHEMBL28021414 0.78 ADRB1 (0.42) ADRB1HTR7HTR3AHTR1AHTR3E
Methylpiperazine SCHEMBL54849 0.77

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-104046246-B The chemical-mechanical planarization of tungsten-containing substrate 气体产品与化学公司 2016-06-15 CN claimed
CN-104046246-B The chemical-mechanical planarization of tungsten-containing substrate 气体产品与化学公司 2016-06-15 CN disclosed