SCHEMBL6961995

SCHEMBL6961995

CNc1[nH]nc(CCOC)c1N

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.34

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
SCHEMBL6236962 0.82 TKT (0.38)
SCHEMBL7592633 0.80
SCHEMBL1436689 0.78 HCAR2 (0.38) HCAR2
Sulfuric Acid SCHEMBL9355323 0.76 TKT (0.34)
SCHEMBL1559608 0.67 HCAR2 (0.38) HCAR2
SCHEMBL16846497 0.64 DYRK1A (0.39) HCAR2
SCHEMBL22816836 0.64 HCAR2 (0.39) HCAR2
SCHEMBL9355615 0.63 ILK (0.32)
SCHEMBL15555300 0.63 HCAR2 (0.38) HCAR2
SCHEMBL2790976 0.62 ALDH1A1 (0.34)

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-1339693-A1 DIAMINOPYRAZOLE DERIVATIVES AND THEIR USE FOR OXIDATION DYEING OF KERATINOUS FIBRES L'OREAL (FR) 2003-09-03 EP claimed
WO-2002046165-A1 DIAMINOPYRAZOLE DERIVATIVES AND THEIR USE FOR OXIDATION DYEING OF KERATINOUS FIBRES L'OREAL (FR) 2002-06-13 WO claimed
EP-1339693-A1 DIAMINOPYRAZOLE DERIVATIVES AND THEIR USE FOR OXIDATION DYEING OF KERATINOUS FIBRES L'OREAL (FR) 2003-09-03 EP disclosed
WO-2002046165-A1 DIAMINOPYRAZOLE DERIVATIVES AND THEIR USE FOR OXIDATION DYEING OF KERATINOUS FIBRES L'OREAL (FR) 2002-06-13 WO disclosed