Toluene

Toluene

SCHEMBL28113409

Cc1ccc(OP(=O)(Oc2ccc(C)cc2)Oc2ccc(C)cc2)cc1.Cc1ccccc1

nearest known ligand 0.83

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.83
CYP3A4 P08684 2/20 0.83
MEN1 O00255 7/20 0.55
KMT2A Q03164 7/20 0.55
LMNA P02545 3/20 0.55
MAPT P10636 1/20 0.54
NPSR1 Q6W5P4 2/20 0.53
ALDH1A1 P00352 2/20 0.50
MAPK1 P28482 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
ALOX12 P18054 1/20 0.48
ACHE P22303 1/20 0.48
HSP90AA1 P07900 1/20 0.47
GAA P10253 1/20 0.47
SRC P12931 1/20 0.45
HCRTR1 O43613 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44

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 SCHEMBL28050506 0.98 TSHR (0.79) TSHRCYP3A4MEN1KMT2ALMNA
SCHEMBL381595 0.96 CYP3A4 (0.83) TSHRCYP3A4MEN1KMT2ALMNA
SCHEMBL35597 0.96 CYP3A4 (0.83) TSHRCYP3A4MEN1KMT2ALMNA
SCHEMBL9657737 0.96 CYP3A4 (0.83) TSHRCYP3A4MEN1KMT2ALMNA
Triphenyl Phosphate SCHEMBL4087814 0.96 CYP3A4 (0.83) TSHRCYP3A4MEN1KMT2ALMNA
Triphenyl Phosphate SCHEMBL27323542 0.96 CYP3A4 (0.83) TSHRCYP3A4MEN1KMT2ALMNA
Benzene SCHEMBL27257404 0.96 CYP3A4 (0.91) TSHRCYP3A4MEN1KMT2ALMNA
Benzene SCHEMBL28262633 0.93 CYP3A4 (0.86) TSHRCYP3A4MEN1KMT2ALMNA
Biphenyl SCHEMBL28859831 0.92 CYP3A4 (0.76) TSHRCYP3A4MEN1KMT2ALMNA
SCHEMBL10336991 0.91 TSHR (1.00) TSHRCYP3A4MEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109705412-A A kind of oil resistant conveyer and its preparation process 青岛环球输送带有限公司 2019-05-03 CN claimed
CN-106257984-B Accelerated cure of moisture curable polyurethane adhesive compositions useful for bonding glass 陶氏环球技术有限责任公司 2019-08-30 CN disclosed
CN-106163931-B For applying the improved method and apparatus for matching reactive two part systems 陶氏环球技术有限责任公司 2019-05-17 CN disclosed
CN-109476802-A Method for improving the surface smoothness of increasing material manufacturing product 陶氏环球技术有限责任公司 2019-03-15 CN disclosed
CN-109385070-A The cable sheath of polymeric blends containing polyvinyl butyral and thermoplastic polyurethane 耐克森公司 2019-02-26 CN disclosed
CN-208535342-U A kind of high temperature resistant PVC tubing 泉州兴源塑料有限公司 2019-02-22 CN disclosed
CN-108704492-A A kind of preparation method of porous silicon carbide ceramic membrane 台州利欧环保新材料有限公司 2018-10-26 CN disclosed
CN-108658604-A A kind of preparation method of porous silicon carbide flat ceramic supporter 台州利欧环保新材料有限公司 2018-10-16 CN disclosed
CN-103502616-B Friction reduction for engine assembly 乔治·华盛顿大学 2017-04-12 CN disclosed
CN-106163931-A For the method and apparatus executing the improvement joining reactive two part system 陶氏环球技术有限责任公司 2016-11-23 CN disclosed