SCHEMBL1666461

SCHEMBL1666461

O=C(Nc1ccc(-n2ncc3cc(Nc4ccc(N5CCC(O)CC5)cc4)ccc32)cc1)c1ccncc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.50
CRACR2A Q9BSW2 2/20 0.48
TNIK Q9UKE5 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
GAA P10253 2/20 0.45
MAPK10 P53779 6/20 0.44
MAPK8 P45983 5/20 0.44
MAOB P27338 1/20 0.43
MAPK13 O15264 2/20 0.42
MAPK12 P53778 2/20 0.42
MAPK11 Q15759 2/20 0.42
MAPK14 Q16539 2/20 0.42
KDM4E B2RXH2 1/20 0.41
HPGD P15428 1/20 0.41
TP53 P04637 2/20 0.41
ALDH1A1 P00352 1/20 0.41
GFER P55789 1/20 0.41
MEN1 O00255 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
SCHEMBL1666463 0.94 MAPT (0.52) MAPTCRACR2ATNIKSMN1; SMN2NPC1
SCHEMBL1665369 0.91 MAPT (0.43) MAPTCRACR2ATNIKSMN1; SMN2NPC1
SCHEMBL6126509 0.91 SMN1; SMN2 (0.45) MAPTTNIKSMN1; SMN2NPC1RAB9A
SCHEMBL1664474 0.89 TNIK (0.46) MAPTTNIKSMN1; SMN2NPC1RAB9A
SCHEMBL1666883 0.89 MAPK1 (0.47) MAPTTNIKSMN1; SMN2NPC1RAB9A
SCHEMBL1664914 0.89 TNIK (0.44) MAPTTNIKSMN1; SMN2NPC1RAB9A
SCHEMBL1665075 0.89 NPC1 (0.41) MAPTTNIKSMN1; SMN2NPC1RAB9A
SCHEMBL1663342 0.88 MAOB (0.52) MAPTTNIKSMN1; SMN2NPC1RAB9A
SCHEMBL1664303 0.88 MAPK10 (0.45) MAPTTNIKSMN1; SMN2NPC1RAB9A
SCHEMBL1665022 0.87 MAPK10 (0.44) MAPTTNIKSMN1; SMN2NPC1RAB9A

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-2488486-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES Ligand Pharmaceuticals Inc. (US) 2012-08-22 EP disclosed
WO-2011046954-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2011-04-21 WO disclosed