SCHEMBL6067683

SCHEMBL6067683

C=C(CCCC)C(=O)OC(=O)CC(=C)C(=O)OC(=O)C(=C)CCCC

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CES1 P23141 3/20 0.37
CES2 O00748 2/20 0.37
ALDH1A1 P00352 4/20 0.35
TP53 P04637 1/20 0.34
TSHR P16473 3/20 0.34
NAAA Q02083 1/20 0.33
DGKA P23743 1/20 0.33
CA1 P00915 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
POLB P06746 1/20 0.32
POLA1 P09884 1/20 0.32
CA12 O43570 1/20 0.32
CA14 Q9ULX7 1/20 0.32
LMNA P02545 2/20 0.32

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
SCHEMBL6916133 0.88 CES1 (0.46) CES1CES2ALDH1A1TP53TSHR
SCHEMBL15191957 0.87 MGAM (0.39) CES1CES2ALDH1A1TP53TSHR
SCHEMBL6057358 0.84 CES1 (0.42) CES1CES2ALDH1A1TP53TSHR
SCHEMBL3862259 0.84 CES1 (0.42) CES1CES2ALDH1A1TP53TSHR
SCHEMBL31619146 0.82 DGKA (0.47) CES1CES2ALDH1A1TSHRNAAA
SCHEMBL31619147 0.82 DGKA (0.47) CES1CES2ALDH1A1TSHRNAAA
SCHEMBL15399814 0.82 DGKA (0.47) CES1CES2ALDH1A1TSHRNAAA
SCHEMBL9534599 0.82 CES2 (0.48) CES1CES2ALDH1A1TSHR
SCHEMBL4951117 0.82 ALDH1A1 (0.32) ALDH1A1
SCHEMBL2483865 0.81 TSHR (0.48) CES1CES2ALDH1A1TP53TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040037947-A1 Document security processes XEROX CORPORATION 2004-02-26 US claimed
US-6673500-B1 Document security processes XEROX CORPORATION 2004-01-06 US claimed
US-7052730-B2 Document security processes XEROX CORPORATION (US) 2006-05-30 US disclosed
US-20040037947-A1 Document security processes XEROX CORPORATION 2004-02-26 US disclosed
US-6673500-B1 Document security processes XEROX CORPORATION 2004-01-06 US disclosed