SCHEMBL6053155

SCHEMBL6053155

CCCc1nc2cnc3ccccc3c2n1CCCC(C)NC(=O)COC

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
HPGD P15428 1/20 0.38
TLR7 Q9NYK1 2/20 0.38
RECQL P46063 1/20 0.38
RXFP1 Q9HBX9 1/20 0.37

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
SCHEMBL6053086 0.85 TP53 (0.49) GAAHTTSMN1; SMN2LMNATP53
SCHEMBL5618682 0.84 TLR7 (0.40) GAASMN1; SMN2LMNAHPGDTLR7
SCHEMBL6053148 0.84 TLR7 (0.43) GAAHTTSMN1; SMN2LMNATP53
SCHEMBL5618174 0.81 SMN1; SMN2 (0.39) GAAHTTSMN1; SMN2LMNATP53
SCHEMBL5617844 0.81 TLR7 (0.45) GAAHTTSMN1; SMN2LMNAHPGD
SCHEMBL5617819 0.80 TLR7 (0.39) GAAHTTSMN1; SMN2LMNATP53
SCHEMBL4148847 0.78 SMN1; SMN2 (0.46) GAAHTTSMN1; SMN2LMNATP53
SCHEMBL6053167 0.78 TLR7 (0.42) GAAHTTSMN1; SMN2LMNATP53
SCHEMBL5618179 0.77 TLR7 (0.39) SMN1; SMN2TLR7RXFP1
SCHEMBL1950119 0.77 GAA (0.47) GAAHTTSMN1; SMN2LMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1686992-A2 HYDROXYLAMINE AND OXIME SUBSTITUTED IMIDAZOQUINOLINES, IMIDAZOPYRIDINES, AND IMIDAZONAPHTHYRIDINES 3M Innovative Properties Company (US) 2006-08-09 EP disclosed
WO-2005051324-A2 HYDROXYLAMINE AND OXIME SUBSTITUTED IMIDAZOQUINOLINES, IMIDAZOPYRIDINES, AND IMIDAZONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-06-09 WO disclosed