Benzene

Benzene

SCHEMBL28600486

O=S(=O)(O)c1ncco1.c1ccccc1

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CES1 P23141 3/20 0.33
NAPRT Q6XQN6 1/20 0.32
FAAH O00519 2/20 0.32
NCEH1 Q6PIU2 1/20 0.32
HPGDS O60760 1/20 0.32
KDM4E B2RXH2 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
LTA4H P09960 1/20 0.31
CHRNB2 P17787 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA7 P36544 1/20 0.30
CHRNA4 P43681 1/20 0.30
COMT P21964 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
SCHEMBL329096 0.96
Hydrochloric Acid SCHEMBL28047346 0.93 CHRNB2 (0.31) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL502841 0.77 CHRNB2 (0.30) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL329095 0.75
SCHEMBL28516259 0.73
SCHEMBL1029001 0.73
SCHEMBL4419837 0.73
SCHEMBL31501516 0.68
SCHEMBL29008956 0.68
SCHEMBL19115330 0.68 SMN1; SMN2 (0.33) SMN1; SMN2KDM4E

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-113243378-B Bispyribac-sodium-containing compound weeding composition and application thereof 江苏瑞邦农化股份有限公司 2022-03-29 CN disclosed
CN-113243378-A Bispyribac-sodium-containing compound weeding composition and application thereof 江苏瑞邦农化股份有限公司 2021-08-13 CN disclosed