SCHEMBL1666767

SCHEMBL1666767

Nc1ccc(CNc2ccc(-n3ncc4cc(NC(=O)c5ccc6[nH]ccc6c5)ccc43)cc2)nc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.43
MAOA P21397 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
PRKCI P41743 1/20 0.42
MAPT P10636 1/20 0.41
ABL1 P00519 1/20 0.41
AURKA O14965 1/20 0.39
NFATC1 O95644 1/20 0.39
TAS2R8 Q9NYW2 1/20 0.39
IMPDH2 P12268 1/20 0.39
ATR Q13535 1/20 0.38
MLLT1 Q03111 1/20 0.37
MAPK10 P53779 1/20 0.37

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
SCHEMBL1666769 0.88 MAOB (0.48) MAOBMAOANPC1RAB9APRKCI
SCHEMBL1665773 0.84 MAOB (0.56) MAOBMAOANPC1RAB9APRKCI
SCHEMBL1664165 0.81 ESR1 (0.48) MAOBMAOANPC1RAB9AMAPT
SCHEMBL1664492 0.80 NPC1 (0.66) MAOBMAOANPC1RAB9AMAPT
SCHEMBL1665007 0.77 MAOB (0.48) MAOBMAOANPC1RAB9AMAPT
SCHEMBL1665429 0.77 ESR1 (0.52) MAOBMAOANPC1RAB9AMAPT
SCHEMBL27918279 0.77 MAOB (0.46) MAOBMAOANPC1RAB9APRKCI
SCHEMBL1664491 0.76 NPC1 (0.58) MAOBMAOANPC1RAB9AMAPT
SCHEMBL1665738 0.76 MAOB (0.46) MAOBMAOANPC1RAB9AMAPT
SCHEMBL1665399 0.76 NPC1 (0.46) MAOBMAOANPC1RAB9AMAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2642994-A2 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS Ligand Pharmaceuticals Incorporated (US) 2013-10-02 EP disclosed
EP-2488486-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES Ligand Pharmaceuticals Inc. (US) 2012-08-22 EP disclosed
WO-2012068406-A2 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS LIGAND PHARMACEUTICALS INCORPORATED (US) 2012-05-24 WO disclosed
WO-2011046954-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2011-04-21 WO disclosed