Toluene

Toluene

SCHEMBL29150558

CCOP(=O)(Cl)Cl.Cc1ccccc1

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
NPSR1 Q6W5P4 1/20 0.48
KCNH2 Q12809 1/20 0.47
ACHE P22303 2/20 0.44
POLB P06746 1/20 0.44
LMNA P02545 3/20 0.44
TSHR P16473 1/20 0.44
ALOX12 P18054 1/20 0.44
NR1I2 O75469 1/20 0.43
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
AOX1 Q06278 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPT P10636 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
Triethyl Phosphate SCHEMBL4555110 0.83 TSHR (0.56) NPSR1KCNH2ACHEPOLBLMNA
Toluene SCHEMBL7257189 0.78 LMNA (0.65) TDP1ACHEPOLBLMNATSHR
Toluene SCHEMBL28198360 0.78 LMNA (0.65) TDP1ACHEPOLBLMNATSHR
SCHEMBL237625 0.78
Toluene SCHEMBL28702929 0.77 NPSR1 (0.46) NPSR1KCNH2ACHEPOLBLMNA
Toluene SCHEMBL28113036 0.75 LMNA (0.61) TDP1ACHEPOLBLMNATSHR
Hydrochloric Acid SCHEMBL28637421 0.75
Toluene SCHEMBL27896618 0.74 AOX1 (0.44) NPSR1KCNH2ACHEPOLBLMNA
Toluene SCHEMBL27291400 0.73 LMNA (0.46) TDP1NPSR1KCNH2ACHELMNA
SCHEMBL11330856 0.73 ACHE (0.55) TP53TDP1NPSR1KCNH2ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116675935-B Flexible metal film shielded cable and preparation method thereof 开开电缆科技有限公司 2024-02-06 CN claimed
CN-116675935-A Flexible metal film shielded cable and preparation method thereof 开开电缆科技有限公司 2023-09-01 CN claimed
CN-116675935-B Flexible metal film shielded cable and preparation method thereof 开开电缆科技有限公司 2024-02-06 CN disclosed
CN-116675935-A Flexible metal film shielded cable and preparation method thereof 开开电缆科技有限公司 2023-09-01 CN disclosed