Benzene

Benzene

SCHEMBL29109286

Cc1cccc(N)c1C.c1ccccc1

nearest known ligand 0.68

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.68
TSHR P16473 4/20 0.68
PIK3CA P42336 1/20 0.68
CD44 P16070 1/20 0.59
TDP1 Q9NUW8 3/20 0.55
ALDH1A1 P00352 4/20 0.54
TRPA1 O75762 1/20 0.46
ATM Q13315 1/20 0.46
CYP1A2 P05177 1/20 0.41
CYP2A6 P11509 1/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
ALOX15 P16050 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
ACHE P22303 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 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
Hydrogen Peroxide SCHEMBL28415811 0.97 CYP3A4 (0.65) CYP3A4TSHRPIK3CACD44TDP1
SCHEMBL29440219 0.97
SCHEMBL15024 0.97
SCHEMBL28788726 0.97 CYP3A4 (0.72) CYP3A4TSHRPIK3CACD44TDP1
Ammonia Solution, Strong SCHEMBL8460462 0.94 CYP3A4 (0.68) CYP3A4TSHRPIK3CACD44TDP1
Hydrochloric Acid SCHEMBL6098611 0.94 CYP3A4 (0.68) CYP3A4TSHRPIK3CACD44TDP1
Ammonia Solution, Strong SCHEMBL3429803 0.94 CYP3A4 (0.68) CYP3A4TSHRPIK3CACD44TDP1
SCHEMBL8218942 0.94
Hydrochloric Acid SCHEMBL154815 0.94 CYP3A4 (0.68) CYP3A4TSHRPIK3CACD44TDP1
Hydrochloric Acid SCHEMBL2188812 0.94 CYP3A4 (0.68) CYP3A4TSHRPIK3CACD44TDP1

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-117050612-B Corrosion-resistant composite aluminum foil for food packaging and processing technology thereof 江苏金天辰新材料有限公司 2023-12-08 CN disclosed
CN-117050612-A Corrosion-resistant composite aluminum foil for food packaging and processing technology thereof 江苏金天辰新材料有限公司 2023-11-14 CN disclosed