SCHEMBL8550313

SCHEMBL8550313

NC(=O)N(Cc1ccc(OCCCCOc2ccc(CN(OCc3ccccc3)C(N)=O)cc2)cc1)OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
ALOX5 P09917 3/20 0.49
PTGS1 P23219 1/20 0.49
PTGS2 P35354 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
FFAR1 O14842 2/20 0.48
PARP10 Q53GL7 1/20 0.48
LTA4H P09960 2/20 0.46
NPC1 O15118 1/20 0.45
HTT P42858 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL8546552 0.99 MEN1 (0.48) MEN1KMT2AALOX5PTGS1PTGS2
SCHEMBL8547009 0.87 NR3C1 (0.48) ALOX5PTGS1PTGS2L3MBTL1FFAR1
SCHEMBL8545528 0.87 NR3C1 (0.48) ALOX5PTGS1PTGS2L3MBTL1FFAR1
SCHEMBL5320045 0.87 PARP10 (0.44) MEN1KMT2AALOX5PTGS1PTGS2
SCHEMBL8550259 0.84 PLA2G10 (0.49) ALOX5PTGS1PTGS2L3MBTL1PARP10
SCHEMBL8549653 0.84 LPAR1 (0.46) ALOX5PTGS1PTGS2L3MBTL1FFAR1
SCHEMBL8549400 0.84 PARP10 (0.49) ALOX5PTGS1PTGS2L3MBTL1FFAR1
SCHEMBL8545520 0.83 PPIB (0.51) MEN1KMT2AALOX5PTGS1PTGS2
SCHEMBL8546496 0.82 NR3C1 (0.47) ALOX5FFAR1
SCHEMBL8549623 0.80 NR3C1 (0.43) MEN1KMT2AALOX5PTGS1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0696585-B1 NOVEL BISOXADIAZOLIDINE DERIVATIVE YAMANOUCHI PHARMA CO LTD (JP) 1998-12-16 EP disclosed
US-5643931-A ANTIDIABETIC AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1997-07-01 US disclosed
EP-0696585-A1 NOVEL BISOXADIAZOLIDINE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1996-02-14 EP disclosed