Thymol

Thymol

SCHEMBL5034474

Cc1ccc(C(C)C)c(O)c1.[KH]

nearest known ligand 0.95

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.95
TRPA1 O75762 2/20 0.95
SLC6A2 P23975 2/20 0.95
HTR2B P41595 2/20 0.95
CHRM1 P11229 1/20 0.95
ADRA1A P35348 1/20 0.95
SRC P12931 1/20 0.50
GABRA1 P14867 2/20 0.48
GABRB2 P47870 2/20 0.48
ALDH1A1 P00352 2/20 0.45
GAA P10253 2/20 0.45
TP53 P04637 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
IDO1 P14902 1/20 0.44
TDO2 P48775 1/20 0.44
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
ALOX15 P16050 2/20 0.41
HSD17B10 Q99714 2/20 0.41
HPGD P15428 2/20 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
Thymol SCHEMBL1867982 0.98 LMNA (1.00) LMNATRPA1SLC6A2HTR2BCHRM1
Thymol SCHEMBL30332213 0.98 LMNA (1.00) LMNATRPA1SLC6A2HTR2BCHRM1
Thymol SCHEMBL29579824 0.98 LMNA (1.00) LMNATRPA1SLC6A2HTR2BCHRM1
Thymol SCHEMBL22165 0.98 LMNA (1.00) LMNATRPA1SLC6A2HTR2BCHRM1
Thymol SCHEMBL23932298 0.95 LMNA (0.95) LMNATRPA1SLC6A2HTR2BCHRM1
Thymol SCHEMBL7074408 0.95 LMNA (0.95) LMNATRPA1SLC6A2HTR2BCHRM1
Thymol SCHEMBL4729745 0.95 LMNA (0.95) LMNATRPA1SLC6A2HTR2BCHRM1
Thymol SCHEMBL1668335 0.95 LMNA (0.95) LMNATRPA1SLC6A2HTR2BCHRM1
Thymol SCHEMBL8506977 0.95 LMNA (0.95) LMNATRPA1SLC6A2HTR2BCHRM1
Thymol SCHEMBL5905814 0.95 LMNA (0.95) LMNATRPA1SLC6A2HTR2BCHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104478607-B A kind of Thymol bactericide and preparation method thereof 海南博士威农用化学有限公司 2017-06-16 CN disclosed
CN-104478607-A Thymol bactericide and preparation method thereof TANG RUI 2015-04-01 CN disclosed
EP-2002721-A2 Tea seed residues and natural tea saponin products Denka International Holding B.V. (NL) 2008-12-17 EP disclosed
WO-2002028382-A9 COMPOSITIONS FOR INJECTION OR INTRAVENOUS ADMINISTRATION FOR THE TREATMENT OF INTERNAL INFECTION OR INFLAMMATION IN HUMANS AND ANIMALS NINKOV DUSAN (US) 2003-02-13 WO disclosed
US-20020103261-A1 Compositions for injection or intravenous administration for the treatment of internal infection or inflammation in humans and animals VAN BEEK GLOBAL, LLC 2002-08-01 US disclosed
WO-2002028382-A1 COMPOSITIONS FOR INJECTION OR INTRAVENOUS ADMINISTRATION FOR THE TREATMENT OF INTERNAL INFECTION OR INFLAMMATION IN HUMANS AND ANIMALS VAN BEEK, RON (US) 2002-04-11 WO disclosed
US-4045290-A Diagnostic method and compounds for use therewith PRINCETON BIOMEDIX INCORPORATED (US) 1977-08-30 US disclosed