SCHEMBL9744429

SCHEMBL9744429

NC(=O)C1CCCC(C2CCc3ccccc3NC2=O)C1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PYGL P06737 5/20 0.39
PYGM P11217 5/20 0.39
PTK2B Q14289 1/20 0.38
MAPT P10636 1/20 0.38
RIPK1 Q13546 5/20 0.37
NPC1 O15118 1/20 0.36
MAPK13 O15264 1/20 0.36
MAPK12 P53778 1/20 0.36
MAPK11 Q15759 1/20 0.36
MAPK14 Q16539 1/20 0.36
MTNR1A P48039 1/20 0.36
IDO1 P14902 1/20 0.33

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
SCHEMBL4826771 0.74 PTK2B (0.47) PYGLPYGMPTK2BMAPTRIPK1
SCHEMBL16313799 0.72 NPC1 (0.45) PYGLPYGMMAPTRIPK1NPC1
SCHEMBL2604338 0.72 NPC1 (0.45) PYGLPYGMMAPTRIPK1NPC1
SCHEMBL9744419 0.70
SCHEMBL1270022 0.67 NPC1 (0.52) PYGLPYGMPTK2BMAPTNPC1
SCHEMBL1270418 0.67 NPC1 (0.52) PYGLPYGMPTK2BMAPTNPC1
SCHEMBL1269652 0.67 NPC1 (0.52) PYGLPYGMPTK2BMAPTNPC1
SCHEMBL13904707 0.67 NPC1 (0.52) PYGLPYGMPTK2BMAPTNPC1
SCHEMBL29415830 0.67 NPC1 (0.52) PYGLPYGMPTK2BMAPTNPC1
SCHEMBL30491873 0.67 BRD4 (0.39) PYGLPYGMMAPTIDO1

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-1992016524-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1992-10-01 WO disclosed