Toluene

Toluene

SCHEMBL1121844

Cc1ccccc1.Cc1ccccc1.[Zn]

nearest known ligand 0.92

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 7/20 0.92
TSHR P16473 2/20 0.92
LMNA P02545 1/20 0.92
ALOX12 P18054 1/20 0.92
TDP1 Q9NUW8 2/20 0.54
HPGD P15428 2/20 0.50
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
NPSR1 Q6W5P4 1/20 0.43
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HTT P42858 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CYP2C19 P33261 1/20 0.40
POLB P06746 1/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40

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
Toluene SCHEMBL6946264 1.00
Toluene SCHEMBL1 0.96
Toluene SCHEMBL4429042 0.96 ACHE (1.00) ACHETSHRLMNAALOX12TDP1
SCHEMBL12344964 0.96 ACHE (1.00) ACHETSHRLMNAALOX12TDP1
Toluene SCHEMBL8824270 0.96 ACHE (1.00) ACHETSHRLMNAALOX12TDP1
Toluene SCHEMBL175861 0.96 ACHE (1.00) ACHETSHRLMNAALOX12TDP1
Toluene SCHEMBL8938900 0.96 ACHE (1.00) ACHETSHRLMNAALOX12TDP1
SCHEMBL12344943 0.96 ACHE (1.00) ACHETSHRLMNAALOX12TDP1
Toluene SCHEMBL4535818 0.96 ACHE (1.00) ACHETSHRLMNAALOX12TDP1
Toluene SCHEMBL8433895 0.96 ACHE (1.00) ACHETSHRLMNAALOX12TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180002505-A1 POLYPROPYLENE RESIN COMPOSITION WITH IMPROVED FOAMING CAPABILITY HYUNDAI MOTOR COMPANY (KR) 2018-01-04 US claimed
US-20240217200-A1 Core and Shell Composite Structural Member TUNDRA COMPOSITES LLC (US) 2024-07-04 US disclosed
US-10301463-B2 Thermally hardenable preparations HENKEL AG & CO. KGAA (DE) 2019-05-28 US disclosed
US-20180002505-A1 POLYPROPYLENE RESIN COMPOSITION WITH IMPROVED FOAMING CAPABILITY HYUNDAI MOTOR COMPANY (KR) 2018-01-04 US disclosed
EP-2084051-B1 EXPANDABLE FILLER INSERT AND METHODS OF PRODUCING THE EXPANDABLE FILLER INSERT HENKEL AG & CO KGAA (DE) 2016-03-09 EP disclosed
US-20140131910-A1 THERMALLY HARDENABLE PREPARATIONS HENKEL AG & CO. KGAA (DE) 2014-05-15 US disclosed
EP-2064281-B1 SOLID EXPANDABLE COMPOSITIONS HENKEL AG & CO KGAA (DE) 2011-02-09 EP disclosed
US-20110024933-A1 EXPANDABLE FILLER INSERT AND METHODS OF PRODUCING THE EXPANDABLE FILLER INSERT HENKEL AG & CO, KGAA (DE) 2011-02-03 US disclosed
US-20090239962-A1 SOLID EXPANDABLE COMPOSITIONS HENKEL AG & CO. KGAA (DE) 2009-09-24 US disclosed
EP-2064281-A1 SOLID EXPANDABLE COMPOSITIONS Henkel AG & Co. KGaA (DE) 2009-06-03 EP disclosed
WO-2008034755-A1 SOLID EXPANDABLE COMPOSITIONS HENKEL AG & CO. KGAA (DE) 2008-03-27 WO disclosed