SCHEMBL16743571

SCHEMBL16743571

Cc1nc(SSc2nnc(C)c(O)n2)nnc1O

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL14611713 0.76 MAPT (0.37) ALDH1A1
SCHEMBL14611722 0.71 POLB (0.34) ALDH1A1
SCHEMBL5299057 0.71 HSP90AA1 (0.38) ALDH1A1
SCHEMBL3236065 0.69 MAPT (0.45) ALDH1A1
SCHEMBL14611721 0.68 ALDH1A1 (0.42) ALDH1A1
SCHEMBL14611586 0.67 LMNA (0.41) ALDH1A1
SCHEMBL14611712 0.66 ALDH1A1 (0.42) ALDH1A1
SCHEMBL14611587 0.66 KDM1A (0.34) ALDH1A1
SCHEMBL14611718 0.66 USP2 (0.43) ALDH1A1
SCHEMBL2878722 0.65

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
EP-2697302-B1 RUBBER COMPOSITION INCLUDING A 1,2,4-TRIAZINE DERIVATIVE MICHELIN & CIE (FR) 2015-06-03 EP disclosed
US-9040618-B2 Rubber composition including a 1,2,4-triazine derivative COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2015-05-26 US disclosed
US-9040618-B2 Rubber composition including a 1,2,4-triazine derivative COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2015-05-26 US disclosed