Toluene

Toluene

SCHEMBL34952

COC(C)=O.Cc1ccccc1

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.55
TSHR P16473 2/20 0.55
ALOX12 P18054 1/20 0.55
ACHE P22303 1/20 0.55
ALDH1A1 P00352 3/20 0.50
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
TDP1 Q9NUW8 2/20 0.48
CES2 O00748 1/20 0.48
CES1 P23141 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.45
MAPT P10636 2/20 0.45
KCNN4 O15554 1/20 0.45
NAPRT Q6XQN6 1/20 0.44
HSD17B10 Q99714 1/20 0.44
HSP90AA1 P07900 1/20 0.44
GAA P10253 1/20 0.44
POLB P06746 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 SCHEMBL27753012 0.98 LMNA (0.52) LMNATSHRALOX12ACHEALDH1A1
Toluene SCHEMBL27495691 0.89 NPC1 (0.46) LMNATSHRALOX12ACHEALDH1A1
Toluene SCHEMBL11482977 0.88 MEN1 (0.44) LMNATSHRALOX12ACHEALDH1A1
P-Xylene SCHEMBL28141567 0.87 TDP1 (0.61) LMNAACHEALDH1A1NPC1RAB9A
Toluene SCHEMBL28015682 0.85 LMNA (0.55) LMNATSHRALOX12ACHEALDH1A1
Toluene SCHEMBL2869829 0.85 LMNA (0.55) LMNATSHRALOX12ACHEALDH1A1
Toluene SCHEMBL28795641 0.85 LMNA (0.55) LMNATSHRALOX12ACHEALDH1A1
Toluene SCHEMBL2869833 0.85 LMNA (0.55) LMNATSHRALOX12ACHEALDH1A1
Toluene SCHEMBL5665635 0.85 LMNA (0.55) LMNATSHRALOX12ACHENPC1
Toluene SCHEMBL5776784 0.84 LMNA (0.69) 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 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6844302-B1 Encapsulated flavor and fragrance INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2005-01-18 US claimed
CN-111373015-B Thiolated hydrophilic ligands for improving reliability of quantum dots in resin films 昭荣化学工业株式会社 2024-06-04 CN disclosed
US-20240178349-A1 QUANTUM DOT STRUCTURE AND METHOD OF PRODUCING A QUANTUM DOT STRUCTURE OSRAM OPTO SEMICONDUCTORS GMBH (DE) 2024-05-30 US disclosed
EP-4363930-A1 PHOTORESIST PROCESS Helio Display Materials Limited (GB) 2024-05-08 EP disclosed
CN-117616333-A Photoresist process 海立尔显示材料有限公司 2024-02-27 CN disclosed
WO-2023275316-A1 PHOTORESIST PROCESS Helio Display Materials Limited (GB) 2023-01-05 WO disclosed
CN-114213585-A Method for preparing petroleum resin by sonochemical method 恒河材料科技股份有限公司 2022-03-22 CN disclosed
US-11021651-B2 Thiolated hydrophilic ligands for improved quantum dot reliability in resin films NANOSYS, INC. (US) 2021-06-01 US disclosed
WO-2020260293-A1 QUANTUM DOT STRUCTURE AND METHOD OF PRODUCING A QUANTUM DOT STRUCTURE OSRAM OPTO SEMICONDUCTORS GMBH (DE) 2020-12-30 WO disclosed
US-20200403126-A1 Quantum Dot Structure and Method of Producing a Quantum Dot Structure OSRAM OPTO SEMICONDUCTORS GMBH (DE) 2020-12-24 US disclosed
CN-1198154-A 2,4,5-trisubstituted phenylketo-enols for use as pesticides and herbicides BAYER AG (DE) 1998-11-04 CN disclosed
US-5688791-A COMPOUNDS FOR TREATMENNT OF VIRAL DISEASES SUCH AS AIDS UBE INDUSTRIES, LTD. (JP) 1997-11-18 US disclosed
US-5504085-A TREATING ISCHEMIA, ANOXIA, HYPOGLYCEMIA AND HEAD, SPINAL CORD TRAUMA NOVO NORDISK A/S (DK) 1996-04-02 US disclosed
CN-1082055-A Polymeric lewis X saccharide and preparation method thereof MERCK PATENT GMBH (DE) 1994-02-16 CN disclosed
US-5250540-A For treatment of disorders of the central nervous system BAYER AKTIENGESELLSCHAFT (DE) 1993-10-05 US disclosed
CN-1050719-A The preparation method of epipodophyllotoxin altrose glycoside derivates BRISTOL MYERS SQUIBB CO (US) 1991-04-17 CN disclosed
US-4755434-A Applying cationic electrodeposition paint, barrier layer of modified polyolefin and corrosion preventive pigment, top coating paint KANSAI PAINT CO., LTD. (JP) 1988-07-05 US disclosed
US-4652560-A ANTIBIOTICS, BACTERICIDES BEECHAM GROUP P.L.C. (GB) 1987-03-24 US disclosed
US-4539202-A SYNERGISTIC MIXTURE WITH PENICILLINS BEECHAM GROUP P.L.C. (GB) 1985-09-03 US disclosed
US-4349481-A Tritiated gibberellin aldehydes AKADEMIE DER WISSENSCHAFTEN DER DDR (DD) 1982-09-14 US disclosed