SCHEMBL3374555

SCHEMBL3374555

COC(C)c1n[nH]c(N)c1N

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.30
PTK2B Q14289 2/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL144679 0.78 GAA (0.41) GAAPTK2BSMN1; SMN2
SCHEMBL4730394 0.76 GAA (0.33) GAAPTK2BSMN1; SMN2
Hydrochloric Acid SCHEMBL9358556 0.76 GAA (0.40) GAAPTK2BSMN1; SMN2
Sulfuric Acid SCHEMBL5202893 0.68 GAA (0.35) GAAPTK2BSMN1; SMN2
SCHEMBL5252528 0.62 GAA (0.40) GAAPTK2BSMN1; SMN2
SCHEMBL14722846 0.62 KDM4E (0.46) GAASMN1; SMN2
SCHEMBL15186345 0.60
SCHEMBL1231721 0.59
SCHEMBL34144 0.58
SCHEMBL21542668 0.58 GAA (0.33) GAAPTK2BSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1586303-A1 Dye composition comprising at least one diaminopyrazole as oxidation base and at least one 6-alkoxy-2,3-diaminopyridine as coupler L'OREAL (FR) 2005-10-19 EP claimed
EP-1457198-A1 Dyeing composition comprising at least one diaminopyrazole precursor and at least one 6-alcoxy 2,3-diaminopyridine coupler L'OREAL (FR) 2004-09-15 EP claimed
EP-1642567-B1 Colouring composition comprising naphthoylene-benzimidazolium compound as direct dye, preparation and uses OREAL (FR) 2010-11-03 EP disclosed
EP-1642567-A1 Colouring composition comprising nyphthoylene-benzimidazolium compound as direct dye, preparation and uses L'OREAL (FR) 2006-04-05 EP disclosed
EP-1586303-A1 Dye composition comprising at least one diaminopyrazole as oxidation base and at least one 6-alkoxy-2,3-diaminopyridine as coupler L'OREAL (FR) 2005-10-19 EP disclosed
EP-1457198-A1 Dyeing composition comprising at least one diaminopyrazole precursor and at least one 6-alcoxy 2,3-diaminopyridine coupler L'OREAL (FR) 2004-09-15 EP disclosed