SCHEMBL7574161

SCHEMBL7574161

O=C1NC(=O)c2cc(Oc3ccc(NC(=O)N(c4ccccc4)C(F)(F)F)cc3)ccc21

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.59
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
HPGD P15428 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
TSHR P16473 2/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
MAOA P21397 4/20 0.55
MAOB P27338 4/20 0.55
POLB P06746 2/20 0.53
GSK3A P49840 1/20 0.52
KDM4E B2RXH2 2/20 0.45
HSD17B10 Q99714 1/20 0.45
MAPT P10636 3/20 0.44
HTT P42858 1/20 0.44
USP2 O75604 1/20 0.44
ALOX15 P16050 1/20 0.44
ATM Q13315 1/20 0.43
CTDSP1 Q9GZU7 1/20 0.41
ALDH1A1 P00352 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
SCHEMBL30949348 0.78 GSK3B (0.67) GSK3BMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL7574156 0.75 MEN1 (0.57) GSK3BMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL27728396 0.75 MEN1 (0.51) MEN1KMT2ASMN1; SMN2TSHRHSD17B10
SCHEMBL30949339 0.75 GSK3B (0.73) GSK3BMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL11515229 0.74 MAOA (1.00) GSK3BMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL30949349 0.72 GSK3B (0.69) GSK3BMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL30949350 0.72 GSK3B (0.69) GSK3BMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL24193545 0.71 LMNA (0.55) MEN1KMT2ASMN1; SMN2MAPTHTT
SCHEMBL30949324 0.71 KMT2A (0.58) GSK3BMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL25726431 0.71 GSK3B (0.58) GSK3BMEN1KMT2AHPGDSMN1; 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
WO-2002062763-A2 INHIBITION OF RAF KINASE USING QUINOLYL ISOQUINOLYL OR PYRIDYL UREAS BAYER CORPORATION (US) 2002-08-15 WO disclosed