SCHEMBL5423902

SCHEMBL5423902

COCCCC(C)n1ncc(N)c1N

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL5416359 0.95 TLR7 (0.31) TLR7ALDH1A1
SCHEMBL5429996 0.90
SCHEMBL5424987 0.83 HCAR3 (0.34)
SCHEMBL5392492 0.81
SCHEMBL5398685 0.78 GAA (0.37)
SCHEMBL5162816 0.78
SCHEMBL5418829 0.78 HTR2A (0.34)
SCHEMBL5429938 0.77 CHRM2 (0.33) TLR7ALDH1A1
SCHEMBL5420469 0.77 NOS3 (0.31)
SCHEMBL5420471 0.77

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-7250063-B2 Diaminopyrazole derivatives and their use for oxidation dyeing of keratinous fibres L'OREAL (FR) 2007-07-31 US disclosed
US-7250063-B2 Diaminopyrazole derivatives and their use for oxidation dyeing of keratinous fibres L'OREAL (FR) 2007-07-31 US disclosed
US-7250063-B2 Diaminopyrazole derivatives and their use for oxidation dyeing of keratinous fibres L'OREAL (FR) 2007-07-31 US disclosed