SCHEMBL13136206

SCHEMBL13136206

CCOC(=O)C1CCN(Cc2ncc(-c3cccc(Nc4cc(C)ccn4)n3)s2)CC1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SYK P43405 11/20 0.52
SMN1; SMN2 Q16637 1/20 0.43
KARS1 Q15046 3/20 0.43
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
MEN1 O00255 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42

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
SCHEMBL13136201 0.90 SYK (0.56) SYKKARS1
SCHEMBL2870296 0.89 SYK (0.51) SYKKARS1KMT2AMEN1
SCHEMBL13136506 0.89 SYK (0.51) SYKKARS1
SCHEMBL2864207 0.88 SYK (0.53) SYKSMN1; SMN2KARS1ALDH1A1MAPT
SCHEMBL2862515 0.86 SYK (0.51) SYKKARS1
SCHEMBL13136236 0.85 SYK (0.51) SYKKARS1
SCHEMBL2869599 0.85 KARS1 (0.58) SYKKARS1
SCHEMBL13136222 0.84 KDR (0.53) SYKKARS1
SCHEMBL13136264 0.84 SYK (0.49) SYKKARS1
SCHEMBL13136367 0.83 SYK (0.49) SYKKARS1

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
US-7803801-B2 Aminopyridine compounds having Syk inhibitory activity JAPAN TOBACCO, INC. (JP) 2010-09-28 US disclosed
US-7803801-B2 Aminopyridine compounds having Syk inhibitory activity JAPAN TOBACCO, INC. (JP) 2010-09-28 US disclosed