SCHEMBL6990117

SCHEMBL6990117

Cc1cc2c(c(C)c1N(C(=O)C1CCNCC1)C(=O)N(C)C)c1ccccc1n2C(C)C

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 8/20 0.44
HTR4 Q13639 7/20 0.37
EZH2 Q15910 2/20 0.34
HTR3E A5X5Y0 1/20 0.32
HTR3B O95264 1/20 0.32
HTR3A P46098 1/20 0.32
HTR3D Q70Z44 1/20 0.32
HTR3C Q8WXA8 1/20 0.32
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
POLB P06746 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL6987001 0.94 NPY5R (0.42) NPY5RHTR4EZH2HTR3EHTR3B
SCHEMBL27604172 0.90 NPY5R (0.45) NPY5RHTR4EZH2HTR3EHTR3B
SCHEMBL6986965 0.86 NPY5R (0.42) NPY5RHTR4EZH2HTR3EHTR3B
SCHEMBL6983375 0.85 NPY5R (0.44) NPY5RHTR4EZH2HTR3EHTR3B
SCHEMBL6990590 0.81 NPY5R (0.40) NPY5RHTR4EZH2HTR3EHTR3B
SCHEMBL6829077 0.79 NPY5R (0.61) NPY5RHTR4POLB
SCHEMBL6823387 0.71 NPY5R (0.61) NPY5REZH2MEN1KMT2A
SCHEMBL6829075 0.69 NPY5R (0.66) NPY5RKMT2A
SCHEMBL6826597 0.68 NPY5R (0.64) NPY5RKMT2A
SCHEMBL6824384 0.68 NPY5R (0.59) NPY5RCYP3A4

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-1358157-A1 CARBAZOLE DERIVATIVES AND THEIR USE AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS AstraZeneca AB (SE) 2003-11-05 EP claimed
WO-2002051806-A1 CARBAZOLE DERIVATIVES AND THEIR USE AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS ASTRAZENECA AB (SE) 2002-07-04 WO claimed
EP-1358157-A1 CARBAZOLE DERIVATIVES AND THEIR USE AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS AstraZeneca AB (SE) 2003-11-05 EP disclosed
WO-2002051806-A1 CARBAZOLE DERIVATIVES AND THEIR USE AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS ASTRAZENECA AB (SE) 2002-07-04 WO disclosed