Benzene

Benzene

SCHEMBL28958130

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

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 3/20 0.36
CA4 P22748 3/20 0.36
CA14 Q9ULX7 2/20 0.36
CES2 O00748 2/20 0.36
CES1 P23141 2/20 0.36
CA5A P35218 2/20 0.36
DAO P14920 1/20 0.36
NAPRT Q6XQN6 1/20 0.36
ALOX15 P16050 1/20 0.36
CA6 P23280 1/20 0.36
CA7 P43166 1/20 0.36
ENPP2 Q13822 1/20 0.36
CA5B Q9Y2D0 1/20 0.36
PCSK9 Q8NBP7 1/20 0.36
ORAI1 Q96D31 1/20 0.36
ORAI2 Q96SN7 1/20 0.36
ORAI3 Q9BRQ5 1/20 0.36
TRPV6 Q9H1D0 1/20 0.36

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
SCHEMBL278265 1.00 TSHR (0.39) TSHRSMN1; SMN2ALDH1A1CA4CA14
SCHEMBL776257 0.85 KCNN4 (0.38) SMN1; SMN2CES2CES1ORAI1ORAI2
SCHEMBL3884017 0.85 CES2 (0.45) TSHRSMN1; SMN2ALDH1A1CES2CES1
SCHEMBL11082106 0.84 CA1 (0.46) TSHRSMN1; SMN2ALDH1A1CA2TDP1
SCHEMBL778809 0.82 EGFR (0.38) CES2CES1CA1CA12CA9
SCHEMBL10639940 0.81 NPSR1 (0.38) TSHRSMN1; SMN2ALDH1A1CA4CA14
SCHEMBL3883006 0.80 ACHE (0.42) TSHRSMN1; SMN2ALDH1A1TDP1MMP2
SCHEMBL779125 0.80 CES2 (0.41) TSHRCES2CES1MMP2MMP1
SCHEMBL12504005 0.78 DBH (0.39) TSHRSMN1; SMN2ALDH1A1CA4CA14
SCHEMBL776024 0.78 HTT (0.35) TSHR

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-218516433-U Biological desulfurization reaction equipment 四川天壹环保科技有限公司 2023-02-24 CN disclosed
CN-217119836-U Biological reaction adsorption desulfurization system 四川天壹环保科技有限公司 2022-08-05 CN disclosed