SCHEMBL8892710

SCHEMBL8892710

CC(C)(C)OC(=O)NCCC/C=C/C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.55
GAA P10253 1/20 0.55
KMT2A Q03164 1/20 0.55
TDP1 Q9NUW8 1/20 0.54
MAOA P21397 1/20 0.48
MAOB P27338 1/20 0.48
CA1 P00915 7/20 0.46
CA2 P00918 7/20 0.46
CA12 O43570 6/20 0.46
CA9 Q16790 6/20 0.46
EPHX1 P07099 1/20 0.39
HTT P42858 1/20 0.39
STK17B O94768 1/20 0.39
STK17A Q9UEE5 1/20 0.39

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
SCHEMBL5199651 1.00 MEN1 (0.55) MEN1GAAKMT2ATDP1MAOA
SCHEMBL3462865 0.95 TDP1 (0.57) MEN1GAAKMT2ATDP1MAOA
SCHEMBL3462867 0.95 TDP1 (0.57) MEN1GAAKMT2ATDP1MAOA
SCHEMBL8411840 0.94 TDP1 (0.59) MEN1GAAKMT2ATDP1MAOA
SCHEMBL7438984 0.94 TDP1 (0.59) MEN1GAAKMT2ATDP1MAOA
SCHEMBL14312158 0.90 MEN1 (0.50) MEN1GAAKMT2ATDP1MAOA
SCHEMBL16858665 0.87 EPHX2 (0.49) MEN1GAAKMT2ATDP1MAOA
SCHEMBL28497839 0.87 EPHX2 (0.49) MEN1GAAKMT2ATDP1MAOA
SCHEMBL13504656 0.87 TDP1 (0.54) MEN1GAAKMT2ATDP1MAOA
SCHEMBL28922732 0.86 TDP1 (0.53) MEN1GAAKMT2ATDP1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2111391-B9 NEW UNSATURATED FATTY AMINO-ACID DERIVATIVES AND USE THEREOF IN DERMAL COSMETOLOGY FABRE PIERRE DERMO COSMETIQUE (FR) 2013-05-29 EP claimed
EP-2111391-B1 NEW UNSATURATED FATTY AMINO-ACID DERIVATIVES AND USE THEREOF IN DERMAL COSMETOLOGY FABRE PIERRE DERMO COSMETIQUE (FR) 2012-10-31 EP claimed
EP-2111391-B9 NEW UNSATURATED FATTY AMINO-ACID DERIVATIVES AND USE THEREOF IN DERMAL COSMETOLOGY FABRE PIERRE DERMO COSMETIQUE (FR) 2013-05-29 EP disclosed
EP-2111391-B1 NEW UNSATURATED FATTY AMINO-ACID DERIVATIVES AND USE THEREOF IN DERMAL COSMETOLOGY FABRE PIERRE DERMO COSMETIQUE (FR) 2012-10-31 EP disclosed
US-5599791-A BACTERICIDE ACTIVE AGAINST GRAMNEGATIVE AND GRAMPOSITIVE BACTERIA GRUPPO LEPETIT SPA (IT) 1997-02-04 US disclosed
WO-1992012172-A9 AMIDES OF ANTIBIOTIC GE 2270 FACTORS 1996-04-04 WO disclosed
EP-0565567-B1 AMIDES OF ANTIBIOTIC GE 2270 FACTORS LEPETIT SPA (IT) 1995-01-18 EP disclosed
CN-1063110-A The amides derivative of the antibiotic GE2270 factor GRUPPOLEPETIT S P A (IT) 1992-07-29 CN disclosed
WO-1992012172-A1 AMIDES OF ANTIBIOTIC GE 2270 FACTORS GRUPPO LEPETIT S.P.A. (IT) 1992-07-23 WO disclosed
EP-0494078-A1 Amides of antibiotic ge 2270 factors GRUPPO LEPETIT S.p.A. (IT) 1992-07-08 EP disclosed