SCHEMBL248084

SCHEMBL248084

COC(=O)c1cc(-c2cccc(F)c2)[nH]c(=O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
ALDH1A1 P00352 6/20 0.47
HPGD P15428 4/20 0.47
KDM4E B2RXH2 3/20 0.47
AHR P35869 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
MAPK1 P28482 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MAPK14 Q16539 1/20 0.45
MAPT P10636 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
TNKS2 Q9H2K2 1/20 0.43
MRGPRX4 Q96LA9 1/20 0.42
PARP1 P09874 1/20 0.42
ALOX5 P09917 1/20 0.42
NPY5R Q15761 1/20 0.41
THRB P10828 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
SCHEMBL731835 0.84 TSHR (0.50) LMNAMEN1KMT2AMAPTRAB9A
SCHEMBL20897631 0.78 VCP (0.53) LMNAMEN1KMT2AALDH1A1HPGD
SCHEMBL29902925 0.78 ALDH1A1 (0.67) LMNAMEN1KMT2AALDH1A1HPGD
SCHEMBL22552141 0.78 ALDH1A1 (0.67) LMNAMEN1KMT2AALDH1A1HPGD
SCHEMBL7829981 0.76 ERN1 (0.58) LMNAMEN1KMT2AMAPTNPC1
SCHEMBL30790370 0.76 ERN1 (0.58) LMNAMEN1KMT2AMAPTNPC1
SCHEMBL1721212 0.76 XDH (0.43) LMNAMEN1KMT2AALDH1A1HPGD
SCHEMBL14153758 0.75 KMT2A (0.60) LMNAMEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL1720931 0.75 MAPT (0.40) MEN1KMT2AALDH1A1KDM4EMAPK1
SCHEMBL30849028 0.74 XDH (0.45) LMNAMEN1KMT2AALDH1A1L3MBTL1

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-2588453-A1 COMPOSITIONS AND METHODS FOR MODULATING THE WNT SIGNALING PATHWAY IRM LLC (BM) 2013-05-08 EP disclosed
WO-2012003189-A1 COMPOSITIONS AND METHODS FOR MODULATING THE WNT SIGNALING PATHWAY IRM LLC (BM) 2012-01-05 WO disclosed