SCHEMBL5529317

SCHEMBL5529317

O=C(O)Oc1noc2c1CN(C(=O)COc1ccccc1)CC2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
L3MBTL1 Q9Y468 3/20 0.46
GAA P10253 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
MAPT P10636 2/20 0.45
TAAR1 Q96RJ0 1/20 0.45
KDM4E B2RXH2 1/20 0.45
USP2 O75604 1/20 0.44
ALDH1A1 P00352 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
POLB P06746 2/20 0.42
LMNA P02545 1/20 0.42
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ME2 P23368 1/20 0.41
ME1 P48163 1/20 0.41
ME3 Q16798 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.41

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
SCHEMBL5531763 0.89 FKBP1A (0.53) MEN1KMT2AMAPTKDM4EPOLB
SCHEMBL5529307 0.89 SMN1; SMN2 (0.57) KMT2AL3MBTL1GAAMAPTKDM4E
SCHEMBL4267581 0.84 KMT2A (0.52) MEN1KMT2AL3MBTL1GAATDP1
SCHEMBL5536542 0.82 L3MBTL1 (0.47) MEN1KMT2AL3MBTL1GAAMAPT
SCHEMBL15062704 0.76 LMNA (0.50) GAAALDH1A1LMNAHPGDNPC1
SCHEMBL5532889 0.76 RAB9A (0.46) MEN1KMT2AGAAMAPTKDM4E
SCHEMBL5531524 0.76 ADORA2A (0.41) L3MBTL1MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL5533937 0.76 ATF4 (0.49) L3MBTL1TDP1MAPTKDM4EALDH1A1
SCHEMBL4263233 0.75 POLB (0.50) MEN1KMT2AL3MBTL1TDP1MAPT
SCHEMBL2582670 0.75 KMT2A (0.55) MEN1KMT2AL3MBTL1GAATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1869053-B1 SUBSTITUTED 4,5,6,7-TETRAHYDRO-ISOXAZOLO[4,5-C]PYRIDINE COMPOUNDS AND THEIR USE IN THE PRODUCTION OF MEDICAMENTS GRUENENTHAL GMBH (DE) 2013-10-09 EP claimed
EP-1869053-A1 SUBSTITUTED 4,5,6,7-TETRAHYDRO-ISOXAZOLO[4,5-C]PYRIDINE COMPOUNDS AND THEIR USE IN THE PRODUCTION OF MEDICAMENTS Grünenthal GmbH (DE) 2007-12-26 EP claimed
WO-2006105945-A1 SUBSTITUTED 4,5,6,7-TETRAHYDRO-ISOXAZOLO[4,5-C]PYRIDINE COMPOUNDS AND THEIR USE IN THE PRODUCTION OF MEDICAMENTS Grünenthal GmbH (DE) 2006-10-12 WO claimed
EP-1869053-B1 SUBSTITUTED 4,5,6,7-TETRAHYDRO-ISOXAZOLO[4,5-C]PYRIDINE COMPOUNDS AND THEIR USE IN THE PRODUCTION OF MEDICAMENTS GRUENENTHAL GMBH (DE) 2013-10-09 EP disclosed