SCHEMBL20526451

SCHEMBL20526451

Cc1occc1S.Cc1occc1S.SS

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.39
KDM4E B2RXH2 2/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.32
NPC1 O15118 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TP53 P04637 1/20 0.32
TSHR P16473 2/20 0.32
POLB P06746 2/20 0.32
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
MAPK1 P28482 2/20 0.31
ESR2 Q92731 1/20 0.31

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
SCHEMBL691744 0.97
SCHEMBL27362498 0.94
Dimethyl Sulfoxide SCHEMBL27341291 0.85 KDM4E (0.34) ALOX5KDM4ELMNA
Acetic Acid SCHEMBL27860997 0.84 KDM4E (0.42) ALOX5KDM4ELMNASMN1; SMN2NPC1
SCHEMBL22555844 0.80 ALDH1A1 (0.37) ALOX5KDM4ELMNATP53
SCHEMBL15874931 0.73 APP (0.35) KDM4ELMNASMN1; SMN2NPC1TP53
SCHEMBL3944953 0.73
SCHEMBL15874932 0.71 ALDH1A1 (0.33) KDM4ESMN1; SMN2NPC1TSHRKMT2A
SCHEMBL28239074 0.69 PTPRC (0.41) ALOX5KDM4ELMNASMN1; SMN2NPC1
SCHEMBL115390 0.67

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-104207092-A Scallion flavored chicken essence and preparation method thereof TIANJIN CHUNFA BIO TECH GROUP 2014-12-17 CN claimed
CN-104187560-A Flavor for spiced chicken with chili sauce and preparation method of flavor TIANJIN CHUNFA BIO TECH GROUP 2014-12-10 CN claimed
EP-3471695-A1 USE OF CERTAIN COMPOUNDS TO MODIFY, REDUCE, OR ELIMINATE OFF-NOTES Symrise AG (DE) 2019-04-24 EP disclosed
EP-3454825-A1 MENTHOL-CONTAINING AROMA PREPARATIONS Symrise AG (DE) 2019-03-20 EP disclosed
EP-3383200-A1 SUBSTANCE MIXTURES Symrise AG (DE) 2018-10-10 EP disclosed
CN-104207092-A Scallion flavored chicken essence and preparation method thereof TIANJIN CHUNFA BIO TECH GROUP 2014-12-17 CN disclosed
CN-104187560-A Flavor for spiced chicken with chili sauce and preparation method of flavor TIANJIN CHUNFA BIO TECH GROUP 2014-12-10 CN disclosed