SCHEMBL190574

SCHEMBL190574

CCCCCCCCCCCCCCCCCC(=O)C(C)(O)C(=O)OC(=O)C(C)O.[CaH2]

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.43
FAAH O00519 8/20 0.41
CES1 P23141 5/20 0.41
CES2 O00748 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CYP1A2 P05177 1/20 0.41
HSD17B10 Q99714 1/20 0.41
LMNA P02545 3/20 0.39
KDM4E B2RXH2 1/20 0.38
DUSP3 P51452 1/20 0.38
DGKA P23743 1/20 0.38

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
SCHEMBL190077 0.97 MAPT (0.43) MAPTFAAHCES1CES2MEN1
SCHEMBL9279130 0.81 MAPT (0.59) MAPTFAAHCES1CES2MEN1
SCHEMBL4143719 0.81 MAPT (0.59) MAPTFAAHCES1CES2MEN1
SCHEMBL15262344 0.77 MAPT (0.39) MAPTMEN1KMT2A
SCHEMBL15261387 0.77 MAPT (0.39) MAPTMEN1KMT2A
SCHEMBL8050066 0.76 MAPT (0.61) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL28398337 0.76 MAPT (0.61) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL8038892 0.76 MAPT (0.61) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL4122283 0.76 PRKCA (0.30)
SCHEMBL28624584 0.76 MAPT (0.61) MAPTMEN1KMT2ALMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8524294-B2 Pressed agglomerates suitable for consumption having retarded aroma release SYMRISE AG (DE) 2013-09-03 US disclosed
EP-1993377-B1 PRESSED AGGLOMERATES SUITABLE FOR CONSUMPTION HAVING RETARDED AROMA RELEASE SYMRISE AG (DE) 2012-01-04 EP disclosed
EP-1804594-B1 PRESSED AROMA AGGLOMERATES SUITABLE FOR CONSUMPTION SYMRISE AG (DE) 2011-10-05 EP disclosed
US-20090246315-A1 PRESSED AGGLOMERATES SUITABLE FOR CONSUMPTION HAVING RETARDED AROMA RELEASE SYMRISE GMBH & CO. KG (DE) 2009-10-01 US disclosed
EP-1993377-A1 PRESSED AGGLOMERATES SUITABLE FOR CONSUMPTION HAVING RETARDED AROMA RELEASE Symrise GmbH & Co. KG (DE) 2008-11-26 EP disclosed
US-20080008801-A1 Pressed Agglomerates Suitable for Consumption SYMRISE GMBH & CO. KG (DE) 2008-01-10 US disclosed
WO-2007098809-A1 PRESSED AGGLOMERATES SUITABLE FOR CONSUMPTION HAVING RETARDED AROMA RELEASE SYMRISE GMBH & CO. KG (DE) 2007-09-07 WO disclosed
EP-1804594-A2 PRESSED AROMA AGGLOMERATES SUITABLE FOR CONSUMPTION Symrise GmbH & Co. KG (DE) 2007-07-11 EP disclosed
WO-2006045742-A2 PRESSED AROMA AGGLOMERATES SUITABLE FOR CONSUMPTION SYMRISE GMBH & CO. KG (DE) 2006-05-04 WO disclosed