SCHEMBL13635888

SCHEMBL13635888

Bc1c(NC(=O)c2c(F)cccc2F)ccn(Cc2cccc(F)c2)c1=O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.50
ALDH1A1 P00352 2/20 0.50
KDM4E B2RXH2 1/20 0.50
MAPT P10636 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
MEN1 O00255 1/20 0.48
HTT P42858 1/20 0.48
KMT2A Q03164 1/20 0.48
PTGER3 P43115 1/20 0.46
TP53 P04637 2/20 0.45
HSD17B13 Q7Z5P4 1/20 0.43
MET P08581 1/20 0.43
AXL P30530 1/20 0.43
POLB P06746 1/20 0.42
THRB P10828 1/20 0.42
MAPK14 Q16539 3/20 0.42
FSCN1 Q16658 1/20 0.42
MAOB P27338 1/20 0.42

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
SCHEMBL4385079 0.88 MAPK14 (0.51) L3MBTL1ALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL13635755 0.77 ALDH1A1 (0.56) L3MBTL1ALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL4480210 0.75 MAPT (0.56) L3MBTL1ALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL4467899 0.75 MAPT (0.54) L3MBTL1ALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL4378804 0.75 MAPK14 (0.56) L3MBTL1ALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL3521076 0.73 MAPT (0.49) L3MBTL1ALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL13635320 0.72 POLB (0.49) L3MBTL1ALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL4476536 0.72 MAPK14 (0.55) L3MBTL1ALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL4390042 0.70 SMN1; SMN2 (0.52) L3MBTL1ALDH1A1KDM4ESMN1; SMN2MEN1
SCHEMBL4466743 0.69 MAPK14 (0.60) L3MBTL1ALDH1A1KDM4EMAPTSMN1; SMN2

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-1490064-B1 SUBSTITUTED PYRIDINONES AS MODULATORS OF P38 MAP KINASE PHARMACIA CORP (US) 2009-11-18 EP disclosed