Benzene

Benzene

SCHEMBL9416754

NC(=O)NNS(=O)(=O)O.c1ccccc1

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ACP1 P24666 2/20 0.33
BCAT1 P54687 1/20 0.32
KAT6A Q92794 3/20 0.31
SRC P12931 1/20 0.31
MAOA P21397 2/20 0.31
TSHR P16473 2/20 0.30
NFKB1 P19838 2/20 0.30
CYP1A2 P05177 1/20 0.30
MAOB P27338 1/20 0.30
THPO P40225 1/20 0.30
CA2 P00918 1/20 0.30
LMNA P02545 1/20 0.30
CYP3A4 P08684 1/20 0.30
CA5A P35218 1/20 0.30
BLM P54132 1/20 0.30
PMP22 Q01453 1/20 0.30
CA9 Q16790 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL2236617 0.92
Methane SCHEMBL9416768 0.90 TSHR (0.33) MAOATSHRNFKB1CYP1A2MAOB
Toluene SCHEMBL7587487 0.84 LMNA (0.44) MEN1KMT2ABCAT1KAT6ATSHR
Isobutane SCHEMBL9416819 0.83 CA14 (0.32)
SCHEMBL27521218 0.73
SCHEMBL28673580 0.73 TSHR (0.37) MAOATSHRNFKB1CYP1A2MAOB
SCHEMBL2361900 0.72 BCAT1 (0.67) MEN1KMT2ABCAT1KAT6ACA2
SCHEMBL2301513 0.70
SCHEMBL2782941 0.69
SCHEMBL21785 0.67

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
EP-0407886-B1 Method for producing plastic hollow parts with foamed walls HOECHST AG (DE) 1994-02-23 EP disclosed
EP-0407886-A2 Method for producing plastic hollow parts with foamed walls HOECHST AKTIENGESELLSCHAFT (DE) 1991-01-16 EP disclosed