Benzene

Benzene

SCHEMBL29129489

NC(=O)Oc1cccs1.c1ccccc1

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.49
MMP2 P08253 1/20 0.49
MMP9 P14780 1/20 0.49
MMP12 P39900 1/20 0.49
DAO P14920 1/20 0.45
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 2/20 0.41
HPGD P15428 2/20 0.41
PKM P14618 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
POLB P06746 2/20 0.40
HPGDS O60760 1/20 0.39
HCAR2 Q8TDS4 1/20 0.38
CYP2C19 P33261 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 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
SCHEMBL1254648 0.98
SCHEMBL1036006 0.84
Hydrochloric Acid SCHEMBL11517510 0.83 MMP1 (0.49) MMP1MMP2MMP9MMP12DAO
SCHEMBL1616681 0.82 MMP1 (0.51) MMP1MMP2MMP9MMP12DAO
SCHEMBL6383050 0.81 MMP1 (0.47) MMP1MMP2MMP9MMP12DAO
SCHEMBL28858282 0.81 MMP1 (0.47) MMP1MMP2MMP9MMP12DAO
SCHEMBL5166429 0.80
SCHEMBL5948338 0.79 MMP1 (0.46) MMP1MMP2MMP9MMP12DAO
SCHEMBL2941993 0.78
SCHEMBL699939 0.78

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-115787007-A Acidic sulfate electronic copper electroplating additive composition and application thereof 厦门大学 2023-03-14 CN claimed