Toluene

Toluene

SCHEMBL11241972

CCC(C)=O.Cc1ccccc1.c1ccccc1

nearest known ligand 0.55

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Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
TSHR P16473 2/20 0.55
ALOX12 P18054 1/20 0.55
ACHE P22303 1/20 0.55
ALDH1A1 P00352 4/20 0.50
TDP1 Q9NUW8 2/20 0.50
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
CES2 O00748 3/20 0.48
CES1 P23141 3/20 0.48
SMN1; SMN2 Q16637 4/20 0.44
POLB P06746 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
MAPT P10636 2/20 0.43
HSD11B1 P28845 1/20 0.41
AKR1C3 P42330 1/20 0.41

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 SCHEMBL9640429 1.00 LMNA (0.55) LMNATSHRALOX12ACHEALDH1A1
Toluene SCHEMBL170599 1.00 LMNA (0.55) LMNATSHRALOX12ACHEALDH1A1
Toluene SCHEMBL9639878 1.00 LMNA (0.55) LMNATSHRALOX12ACHEALDH1A1
Toluene SCHEMBL10621122 0.98 LMNA (0.52) LMNATSHRALOX12ACHEALDH1A1
Toluene SCHEMBL6905806 0.98 LMNA (0.52) LMNATSHRALOX12ACHEALDH1A1
Toluene SCHEMBL27517567 0.98 LMNA (0.52) LMNATSHRALOX12ACHEALDH1A1
Toluene SCHEMBL5367099 0.93 TSHR (0.48) LMNATSHRALOX12ACHEALDH1A1
Toluene SCHEMBL11408666 0.93 LMNA (0.48) LMNATSHRALOX12ACHEALDH1A1
O-Xylene SCHEMBL28182446 0.93 TSHR (0.48) LMNATSHRALOX12ACHEALDH1A1
Toluene SCHEMBL9715675 0.91 LMNA (0.46) LMNATSHRALOX12ACHEALDH1A1

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 43 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102732302-B Production method of bright stock CHINA PETROLEUM & CHEMICAL 2014-12-03 CN claimed
CN-102732302-A Production method of bright stock CHINA PETROLEUM & CHEMICAL 2012-10-17 CN claimed
CN-101074393-B Method for producing petroleum wax and high-viscosity index lube-oil base oil simultaneously CHINA PETROLEUM & CHEMICAL 2011-04-20 CN claimed
CN-100510025-C Method for improving solvent dewaxing efficiency CHINA PETROLEUM & CHEMICAL (CN) 2009-07-08 CN claimed
CN-101074393-A Method for producing petroleum wax and high-viscosity index lube-oil base oil simultaneouslly CHINA PETROCHEMICAL CORP (CN) 2007-11-21 CN claimed
CN-1978597-A Method for improving solvent dewaxing efficiency CHINA PETROCHEMICAL CO LTD (CN) 2007-06-13 CN claimed
CN-1152122-C Solvent dewaxing and de-oiling process by using filter aid 中国石油化工股份有限公司 2004-06-02 CN claimed
CN-1344783-A Solvent dewaxing and de-oiling process by using filter aid CHINA PETROCHEMICAL CO LTD (CN) 2002-04-17 CN claimed
CN-1020745-C PROCESS FOR RECOVERING SOLVENT DURING HYDROCARBON PROCESSING CHINA PETRO CHEMICAL CO (CN) 1993-05-19 CN claimed
CN-1059851-A Method for recovering solvents in the hydro carbons process CHINA PETRO CHEMICAL CO (CN) 1992-04-01 CN claimed
US-4072620-A OXIDATIVE AND THERMALLY STABLE, CORONA RESISTANT, CORROSION RESISTANT NIPPON OIL CO., LTD. (JA) 1978-02-07 US claimed
US-4070297-A Electrical insulating oil compositions NIPPON OIL CO., LTD. (JA) 1978-01-24 US claimed
US-4069166-A DEWAXED, HYDROFINED, DESULFURIZED NIPPON OIL COMPANY, LTD. (JA) 1978-01-17 US claimed
US-4069165-A DEWAXED, HYDROFINED, DESULFURIZED; AN ALKYLBENZENE NIPPON OIL COMPANY, LTD. (JA) 1978-01-17 US claimed
US-4062791-A REFINED OIL BLEND NIPPON OIL CO., LTD. (JA) 1977-12-13 US claimed
US-4008148-A SOLVENT REFINING NIPPON OIL COMPANY LTD. (JA) 1977-02-15 US claimed
CN-102732302-B Production method of bright stock CHINA PETROLEUM & CHEMICAL 2014-12-03 CN disclosed
CN-102242000-B Processing method of heavy hydrocarbon oil CHINA PETROLEUM & CHEMICAL 2013-11-06 CN disclosed
US-4033854-A OXIDATION- AND HEAT-RESISTANT SPECIALTY OILS NIPPON OIL COMPANY, LTD. (JA) 1977-07-05 US disclosed
US-4008148-A SOLVENT REFINING NIPPON OIL COMPANY LTD. (JA) 1977-02-15 US disclosed