SCHEMBL5598733

SCHEMBL5598733

COc1cc(OCc2ccccc2)ccc1CC(=O)Nc1n[nH]c(C)c1C

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 4/20 0.62
PDGFRB P09619 4/20 0.62
KDR P35968 3/20 0.62
MET P08581 1/20 0.51
GSK3B P49841 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
FLT3 P36888 2/20 0.43
FFAR1 O14842 1/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CD274 Q9NZQ7 1/20 0.42
TDP1 Q9NUW8 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
SCHEMBL2174210 0.83 PDGFRB (0.63) CSF1RPDGFRBKDRL3MBTL1MEN1
SCHEMBL4655471 0.80 MET (0.49) CSF1RPDGFRBKDRMETL3MBTL1
SCHEMBL2175521 0.80 PDGFRB (0.63) CSF1RPDGFRBKDRMETL3MBTL1
SCHEMBL2173579 0.77 L3MBTL1 (0.58) L3MBTL1FFAR1ALDH1A1TDP1
SCHEMBL1097150 0.76 L3MBTL1 (0.61) L3MBTL1FFAR1TDP1
SCHEMBL2175292 0.76 PDGFRB (0.63) CSF1RPDGFRBKDRMETL3MBTL1
SCHEMBL3716437 0.76 TAS1R3 (0.53) L3MBTL1MEN1KMT2AFFAR1NPC1
SCHEMBL2175002 0.75 PDGFRB (0.51) CSF1RPDGFRBKDRMETL3MBTL1
SCHEMBL1097529 0.74 FLT3 (0.53) CSF1RPDGFRBMETL3MBTL1MEN1
SCHEMBL2173825 0.74 PDGFRB (0.64) CSF1RPDGFRBKDRFLT3

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-2007113548-A1 NAPHTHYRIDINE DERIVATIVES ASTRAZENECA AB (SE) 2007-10-11 WO disclosed