SCHEMBL5683201

SCHEMBL5683201

CCCc1[nH]c2ccccc2c1C1=C(c2c(C)[nH]c3ccccc23)C(=O)NC1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CAMK2D Q13557 4/20 0.50
PRKCB P05771 4/20 0.47
PRKCA P17252 4/20 0.47
PRKCH P24723 4/20 0.47
PRKCE Q02156 4/20 0.47
PRKCQ Q04759 4/20 0.47
PRKCD Q05655 4/20 0.47
RAB9A P51151 1/20 0.45
HTT P42858 1/20 0.43
CHRNB2 P17787 1/20 0.43
CHRNA7 P36544 1/20 0.43
CHRNA4 P43681 1/20 0.43
CCR6 P51684 1/20 0.43
HKDC1 Q2TB90 1/20 0.43
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
IMPDH2 P12268 1/20 0.40
GSK3B P49841 1/20 0.40
PARP1 P09874 2/20 0.40

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
SCHEMBL7785201 0.86 CAMK2D (0.61) CAMK2DPRKCBPRKCAPRKCHPRKCE
SCHEMBL5686050 0.86 CAMK2D (0.57) CAMK2DPRKCBPRKCAPRKCHPRKCE
SCHEMBL5686010 0.83 CAMK2D (0.50) CAMK2DPRKCBPRKCAPRKCHPRKCE
SCHEMBL7782574 0.83 CAMK2D (0.48) CAMK2DPRKCBPRKCAPRKCHPRKCE
SCHEMBL8316483 0.79 CAMK2D (0.51) CAMK2DPRKCBPRKCAPRKCHPRKCE
SCHEMBL20243386 0.79 CAMK2D (0.55) CAMK2DPRKCBPRKCAPRKCHPRKCE
SCHEMBL15797114 0.79 PRKCB (0.54) CAMK2DPRKCBPRKCAPRKCHPRKCE
SCHEMBL5686034 0.78 CAMK2D (0.48) CAMK2DPRKCBPRKCAPRKCHPRKCE
SCHEMBL22592333 0.78 PDE9A (0.51) CAMK2DPRKCBPRKCAPRKCHPRKCE
SCHEMBL19217026 0.77 CAMK2D (0.50) CAMK2DPRKCBPRKCAPRKCHPRKCE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1140070-A1 TREATMENT OF CONDITIONS WITH A NEED FOR THE INHIBITION OF GSK-3 SMITHKLINE BEECHAM PLC (GB) 2001-10-10 EP claimed
WO-2000038675-A1 TREATMENT OF CONDITIONS WITH A NEED FOR THE INHIBITION OF GSK-3 SMITHKLINE BEECHAM PLC (GB) 2000-07-06 WO claimed
WO-2005028678-A9 METHODS AND MATERIALS FOR IDENTIFYING AGENTS WHICH MODULATE BONE REMODELING AND AGENTS IDENTIFIED THEREBY WYETH CORP (US) 2006-08-31 WO disclosed
EP-1636388-A2 METHODS AND MATERIALS FOR IDENTIFYING AGENTS WHICH MODULATE BONE REMODELING AND AGENTS IDENTIFIED THEREBY Wyeth (US) 2006-03-22 EP disclosed
WO-2005028678-A2 METHODS AND MATERIALS FOR IDENTIFYING AGENTS WHICH MODULATE BONE REMODELING AND AGENTS IDENTIFIED THEREBY WYETH (US) 2005-03-31 WO disclosed