SCHEMBL2485564

SCHEMBL2485564

CCN(C(=O)c1c(O)c2c(C)cccc2[nH]c1=O)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TSHR P16473 2/20 0.43
ALDH1A1 P00352 2/20 0.42
GLA P06280 1/20 0.42
TP53 P04637 2/20 0.41
MAP3K5 Q99683 1/20 0.41
KDM4E B2RXH2 3/20 0.40
NPSR1 Q6W5P4 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
KDM5A P29375 1/20 0.39
HTT P42858 1/20 0.39
HPGD P15428 2/20 0.38
CYP2C9 P11712 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL18751640 0.88 TP53 (0.51) MEN1KMT2ATSHRALDH1A1GLA
SCHEMBL321543 0.86 MEN1 (0.45) MEN1KMT2ATSHRALDH1A1GLA
SCHEMBL7750180 0.86 MEN1 (0.45) MEN1KMT2ATSHRALDH1A1GLA
SCHEMBL1229239 0.86 TP53 (0.41) MEN1KMT2ATSHRALDH1A1GLA
SCHEMBL7559771 0.86 MEN1 (0.50) MEN1KMT2ATSHRALDH1A1GLA
SCHEMBL5785897 0.85 MEN1 (0.44) MEN1KMT2ATSHRALDH1A1GLA
SCHEMBL5189407 0.85 KDM5A (0.40) MEN1KMT2ATSHRALDH1A1GLA
SCHEMBL1830325 0.85 MEN1 (0.44) MEN1KMT2ATSHRALDH1A1GLA
SCHEMBL7556725 0.85 KMT2A (0.43) MEN1KMT2ATSHRALDH1A1GLA
SCHEMBL6202118 0.84 MEN1 (0.43) MEN1KMT2AALDH1A1MAP3K5KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2376456-A2 HIGHLY PURE LAQUINIMOD OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF Actavis Group Ptc Ehf (IS) 2011-10-19 EP claimed
WO-2010070449-A2 HIGHLY PURE LAQUINIMOD OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ACTAVIS GROUP PTC EHF (IS) 2010-06-24 WO claimed
EP-2376456-A2 HIGHLY PURE LAQUINIMOD OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF Actavis Group Ptc Ehf (IS) 2011-10-19 EP disclosed
WO-2010070449-A2 HIGHLY PURE LAQUINIMOD OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ACTAVIS GROUP PTC EHF (IS) 2010-06-24 WO disclosed
EP-1073639-A1 QUINOLINE DERIVATIVES Active Biotech AB (SE) 2001-02-07 EP disclosed
WO-1999055678-A1 QUINOLINE DERIVATIVES ACTIVE BIOTECH AB (SE) 1999-11-04 WO disclosed