SCHEMBL7459847

SCHEMBL7459847

O=C(O)Cc1cc2ccccc2n1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OXER1 Q8TDS5 9/20 0.48
L3MBTL1 Q9Y468 1/20 0.44
DAO P14920 1/20 0.42
ALDH1A1 P00352 2/20 0.42
PLA2G10 O15496 1/20 0.42
KMT2A Q03164 1/20 0.41
MCL1 Q07820 1/20 0.41
CCR2 P41597 1/20 0.41
TSHR P16473 1/20 0.40

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
SCHEMBL16835425 0.84 OXER1 (0.46) OXER1L3MBTL1DAOALDH1A1KMT2A
SCHEMBL1465160 0.81 NOD2 (0.47) OXER1L3MBTL1ALDH1A1KMT2A
SCHEMBL7551690 0.80 OXER1 (0.59) OXER1DAOMCL1CCR2
SCHEMBL30042365 0.79 MCL1 (0.57) DAOALDH1A1KMT2AMCL1
SCHEMBL2343924 0.79 MCL1 (0.57) DAOALDH1A1KMT2AMCL1
SCHEMBL4760174 0.79 NR1H2 (0.45) OXER1L3MBTL1DAOALDH1A1MCL1
SCHEMBL13278192 0.78 ALDH1A1 (0.58) OXER1L3MBTL1DAOALDH1A1PLA2G10
SCHEMBL4592266 0.78 IDH1 (0.43) OXER1DAOPLA2G10KMT2AMCL1
SCHEMBL4467286 0.74 DAO (0.47) OXER1L3MBTL1DAOALDH1A1KMT2A
SCHEMBL16150477 0.74 CYP1A2 (0.49) OXER1L3MBTL1KMT2AMCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1098895-B1 METHOD FOR PREPARING LINTITRIPT POTASSIUM SALT SANOFI SYNTHELABO (FR) 2002-06-05 EP disclosed