SCHEMBL165544

SCHEMBL165544

CCCCCCC(CCCCC)N([N]C(=O)c1ccc(C)cc1)C(=O)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.39
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
CES2 O00748 3/20 0.38
CES1 P23141 3/20 0.38
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37
MMP12 P39900 1/20 0.37
NAAA Q02083 1/20 0.37
HPGD P15428 2/20 0.37
GAA P10253 1/20 0.37
PRSS1 P07477 1/20 0.37
CTSG P08311 1/20 0.37
CTRB1 P17538 1/20 0.37
CMA1 P23946 1/20 0.37
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL165545 0.76 L3MBTL1 (0.48) L3MBTL1MEN1NPC1RAB9AKMT2A
SCHEMBL27597831 0.70 CES2 (0.44) CES2CES1MMP2MMP9MMP12
SCHEMBL165895 0.69 CES2 (0.49) CES2CES1MMP2MMP9MMP12
SCHEMBL8898156 0.69 HPGD (0.43) CES2CES1NAAAHPGDGAA
SCHEMBL21078183 0.67 L3MBTL1 (0.41) L3MBTL1CES2CES1HPGDGAA
SCHEMBL9352846 0.67 L3MBTL1 (0.50) L3MBTL1MEN1KMT2AMMP2MMP9
SCHEMBL9352257 0.67 L3MBTL1 (0.50) L3MBTL1MEN1KMT2AMMP2MMP9
SCHEMBL9352280 0.67 L3MBTL1 (0.50) L3MBTL1MEN1KMT2AMMP2MMP9
SCHEMBL9352667 0.67 L3MBTL1 (0.50) L3MBTL1MEN1KMT2AMMP2MMP9
SCHEMBL28781481 0.66 CES2 (0.45) CES2CES1MMP2MMP9MMP12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2611872-A1 INKJET PRINTING FLUID Eastman Kodak Company (US) 2013-07-10 EP disclosed
WO-2012030546-A1 INKJET PRINTING FLUID EASTMAN KODAK COMPANY (US) 2012-03-08 WO disclosed