SCHEMBL27596647

SCHEMBL27596647

Cc1ccc(NC(=O)Nc2ccc(Oc3ccccc3)cc2)nc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.65
NPC1 O15118 8/20 0.65
SMN1; SMN2 Q16637 6/20 0.65
MAPT P10636 4/20 0.60
L3MBTL1 Q9Y468 2/20 0.58
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
MAPK13 O15264 1/20 0.55
RAF1 P04049 1/20 0.55
MAPK12 P53778 1/20 0.55
MAPK11 Q15759 1/20 0.55
MAPK14 Q16539 1/20 0.55
CA12 O43570 1/20 0.54
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
CA9 Q16790 1/20 0.54
CDK8 P49336 1/20 0.53
GAA P10253 1/20 0.52
HTT P42858 1/20 0.52
HPGD P15428 1/20 0.51

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
SCHEMBL27581139 0.87 RAB9A (0.73) RAB9ANPC1SMN1; SMN2MAPTL3MBTL1
SCHEMBL12994776 0.84 HPGD (0.65) RAB9ANPC1SMN1; SMN2MAPTMEN1
SCHEMBL27578671 0.84 RAB9A (0.70) RAB9ANPC1SMN1; SMN2MAPTL3MBTL1
SCHEMBL27578807 0.83 RAB9A (0.74) RAB9ANPC1SMN1; SMN2MAPTL3MBTL1
SCHEMBL30053559 0.80 CA12 (0.73) RAB9ANPC1SMN1; SMN2MAPTMEN1
SCHEMBL16383911 0.79 RAB9A (1.00) RAB9ANPC1SMN1; SMN2MAPTL3MBTL1
SCHEMBL21295380 0.78 CA12 (0.71) RAB9ASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL23977709 0.77 RAB9A (0.70) RAB9ANPC1SMN1; SMN2MAPTL3MBTL1
SCHEMBL4123004 0.77 RAB9A (0.70) RAB9ANPC1SMN1; SMN2MAPTL3MBTL1
SCHEMBL5788823 0.76 RAB9A (0.58) RAB9ANPC1SMN1; SMN2MAPTL3MBTL1

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
CN-1478771-A Synthesis method of substituted pyridine carbamide compound 中国科学院大连化学物理研究所 2004-03-03 CN disclosed