Benzene

Benzene

SCHEMBL4297098

[SiH3]c1ccccc1.c1ccccc1

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
TSHR P16473 6/20 0.39
DPP4 P27487 2/20 0.39
F2 P00734 1/20 0.39
TDP1 Q9NUW8 3/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA9 Q16790 2/20 0.38
ALOX12 P18054 2/20 0.38
CA12 O43570 1/20 0.38
GLA P06280 1/20 0.38
CA3 P07451 1/20 0.38
CA4 P22748 1/20 0.38
CA14 Q9ULX7 1/20 0.38
LMNA P02545 1/20 0.38
ACHE P22303 1/20 0.38
CA7 P43166 1/20 0.38
HIF1A Q16665 1/20 0.37
CYP2A6 P11509 1/20 0.36
MAPT P10636 1/20 0.35

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
SCHEMBL7942 1.00
SCHEMBL13370283 0.96
Hydrochloric Acid SCHEMBL4462906 0.96 ALDH1A1 (0.40) ALDH1A1TSHRDPP4F2TDP1
SCHEMBL13370282 0.96
Hydrochloric Acid SCHEMBL4462903 0.96 ALDH1A1 (0.40) ALDH1A1TSHRDPP4F2TDP1
Fluoride SCHEMBL704319 0.96 ALDH1A1 (0.40) ALDH1A1TSHRDPP4F2TDP1
Hydrochloric Acid SCHEMBL5929655 0.96
SCHEMBL1778307 0.96
Ammonia Solution, Strong SCHEMBL22686091 0.96
SCHEMBL16054548 0.96

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080081120-A1 Superprimer VAN OOIJ WIM J 2008-04-03 US claimed
WO-2006069376-A2 IMPROVED SUPERPRIMER UNIVERSITY OF CINCINNATI (US) 2006-06-29 WO claimed
US-20090264574-A1 Superprimer VAN OOIJ WIM JOHAN 2009-10-22 US disclosed
US-20090264574-A1 Superprimer VAN OOIJ WIM JOHAN 2009-10-22 US disclosed
US-20080081120-A1 Superprimer VAN OOIJ WIM J 2008-04-03 US disclosed
US-20080081120-A1 Superprimer VAN OOIJ WIM J 2008-04-03 US disclosed
WO-2006069376-A3 IMPROVED SUPERPRIMER UNIV CINCINNATI (US) 2006-10-26 WO disclosed
WO-2006069376-A2 IMPROVED SUPERPRIMER UNIVERSITY OF CINCINNATI (US) 2006-06-29 WO disclosed
WO-2006069376-A2 IMPROVED SUPERPRIMER UNIVERSITY OF CINCINNATI (US) 2006-06-29 WO disclosed