Benzene

Benzene

SCHEMBL27623239

O=C1CN(Sc2ccccc2)C(=O)N1.c1ccccc1

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
ALDH1A1 P00352 2/20 0.46
HSD17B10 Q99714 1/20 0.46
CRBN Q96SW2 5/20 0.38
DDB1 Q16531 3/20 0.38
EPHX2 P34913 1/20 0.36
POLB P06746 1/20 0.35
HTT P42858 1/20 0.35
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
PTPN1 P18031 1/20 0.33
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL62940 1.00 MAPT (0.46) MAPTALDH1A1HSD17B10CRBNDDB1
Alanine SCHEMBL6904183 0.85 ALDH1A1 (0.36) MAPTALDH1A1HSD17B10HTTTDP1
SCHEMBL1421444 0.81 CRBN (0.41) MAPTALDH1A1CRBNDDB1POLB
SCHEMBL9864475 0.81 MAPT (0.38) MAPTALDH1A1HSD17B10CRBNDDB1
SCHEMBL9701179 0.80 TDP2 (0.35) MAPTALDH1A1HSD17B10KDM4ETDP1
SCHEMBL8899344 0.78 KMT2A (0.41) MAPTALDH1A1HSD17B10POLBMEN1
SCHEMBL22498758 0.73 CRBN (0.35) MAPTALDH1A1CRBNDDB1EPHX2
SCHEMBL9751662 0.73 CRBN (0.35) MAPTALDH1A1HSD17B10CRBNDDB1
SCHEMBL9751620 0.72 CRBN (0.43) MAPTALDH1A1HSD17B10CRBNDDB1
SCHEMBL8379436 0.70 MEN1 (0.42) MAPTALDH1A1HSD17B10CRBNDDB1

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-1741810-A Glycopeptide antibiotic derivatives LEUVEN K U RES & DEV (BE) 2006-03-01 CN disclosed