SCHEMBL27538367

SCHEMBL27538367

CN(C)c1nc2ccc(N3CC(O)C(O)C3)nc2cc1N

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 3/20 0.37
CDK2 P24941 3/20 0.37
APAF1 O14727 1/20 0.37
PDE10A Q9Y233 4/20 0.36
MAP4K4 O95819 6/20 0.35
HRH3 Q9Y5N1 1/20 0.33
HRH4 Q9H3N8 1/20 0.32
HTR3A P46098 1/20 0.32
PIK3CA P42336 3/20 0.31
PIK3CD O00329 1/20 0.31
PIK3CB P42338 1/20 0.31
MTOR P42345 1/20 0.31
PIK3CG P48736 1/20 0.31

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
SCHEMBL27516484 0.85 PDE10A (0.46) PDE10AMAP4K4
SCHEMBL2411355 0.83 CDK1 (0.39) CDK1CDK2PDE10AMAP4K4HRH3
SCHEMBL27565772 0.82 MAP4K4 (0.43) APAF1PDE10AMAP4K4HRH4HTR3A
SCHEMBL27516810 0.81 HRH4 (0.44) PDE10AMAP4K4HRH3HRH4HTR3A
SCHEMBL27538307 0.77 TACR1 (0.34) APAF1PDE10A
SCHEMBL27517764 0.77 MCHR1 (0.46) MAP4K4
SCHEMBL27516160 0.76 SCN9A (0.38) APAF1MAP4K4
SCHEMBL27515451 0.72 PDE10A (0.38) CDK1CDK2PDE10A
SCHEMBL27570923 0.69 APAF1 (0.32) APAF1
SCHEMBL2413196 0.69 PDE10A (0.39) CDK1CDK2PDE10AHRH4

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
CN-1250192-C 2,5-diaminopyridine oxidation color display alkali for dyeing keratin fibre OREAL (FR) 2006-04-12 CN claimed
CN-1425365-A 2,5-diaminopyridine oxidation color display alkali for dyeing keratin fibre OREAL (FR) 2003-06-25 CN claimed
CN-1250192-C 2,5-diaminopyridine oxidation color display alkali for dyeing keratin fibre OREAL (FR) 2006-04-12 CN disclosed
CN-1425365-A 2,5-diaminopyridine oxidation color display alkali for dyeing keratin fibre OREAL (FR) 2003-06-25 CN disclosed