SCHEMBL10328

SCHEMBL10328

CC(C)n1c2c(c3ccccc31)C(=O)NCC2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 4/20 0.51
BRD2 P25440 1/20 0.48
BRD3 Q15059 1/20 0.48
CREBBP Q92793 1/20 0.48
BCHE P06276 3/20 0.48
ACHE P22303 2/20 0.48
ALB P02768 1/20 0.48
PKN1 Q16512 1/20 0.44
PKN2 Q16513 1/20 0.44
POLB P06746 1/20 0.43
HTT P42858 1/20 0.43
RIPK3 Q9Y572 1/20 0.42
PRKD3 O94806 1/20 0.41
PRKCG P05129 1/20 0.41
PRKCB P05771 1/20 0.41
PRKCA P17252 1/20 0.41
PRKCH P24723 1/20 0.41
PRKCI P41743 1/20 0.41
PRKCE Q02156 1/20 0.41
PRKCQ Q04759 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
SCHEMBL918 0.80 BRD4 (0.57) BRD4BRD2BRD3CREBBPBCHE
SCHEMBL16201640 0.80 CSNK2B (0.47) CREBBPBCHEACHEPOLBHTT
SCHEMBL7291788 0.78 RIPK3 (0.42) BRD4BRD2BRD3CREBBPBCHE
SCHEMBL15723838 0.78 CSNK2B (0.58) CREBBPPOLBHTTPRKD3PRKCG
SCHEMBL13345818 0.77 BRD4 (0.51) BRD4BRD2BRD3CREBBPBCHE
SCHEMBL1391 0.77 BRD4 (0.64) BRD4BRD2BRD3CREBBPBCHE
SCHEMBL16201649 0.75 CSNK2A2 (0.40) POLBHTTPRKD3PRKCGPRKCB
SCHEMBL854 0.73 BCHE (0.64) BCHEACHEALB
SCHEMBL588 0.71 BCHE (0.69) BRD4BRD2BRD3CREBBPBCHE
SCHEMBL7376810 0.71 BRD4 (0.40) BRD4BRD2BRD3CREBBPBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5360800-A Tetrahydro-1H-pyrido[4,3-b]indol-1-one derivatives GLAXO GROUP LIMITED (GB) 1994-11-01 US disclosed
EP-0306323-B1 Lactam derivatives GLAXO GROUP LTD (GB) 1994-09-21 EP disclosed
EP-0306323-A2 Lactam derivatives GLAXO GROUP LIMITED (GB) 1989-03-08 EP disclosed