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Sugi Predict / Compounds / SCHEMBL13136302

SCHEMBL13136302

SCHEMBL13136302

Cc1ccnc(Nc2cccc(-c3cnc(C4CCN(C(=O)C5CCNCC5)CC4)s3)n2)c1

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KARS1 Q15046 9/20 0.50
▸ SYK P43405 7/20 0.50
▸ MAP3K12 Q12852 4/20 0.44

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
SCHEMBL2865460 0.94 KARS1 (0.51) KARS1SYKMAP3K12
SCHEMBL2865458 0.94 KARS1 (0.51) KARS1SYKMAP3K12
SCHEMBL13136405 0.93 SYK (0.51) KARS1SYKMAP3K12
SCHEMBL2869781 0.90 SYK (0.50) KARS1SYKMAP3K12
SCHEMBL2869782 0.90 SYK (0.50) KARS1SYKMAP3K12
SCHEMBL13136258 0.90 SYK (0.48) KARS1SYKMAP3K12
SCHEMBL2872217 0.89 KARS1 (0.54) KARS1SYKMAP3K12
SCHEMBL2872221 0.89 KARS1 (0.54) KARS1SYKMAP3K12
SCHEMBL13136286 0.89 SYK (0.51) KARS1SYKMAP3K12
SCHEMBL13136103 0.89 SYK (0.53) KARS1SYKMAP3K12

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-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
EP-1854793-A1 NOVEL AMINOPYRIDINE COMPOUND WITH Syk INHIBITORY ACTIVITY Japan Tobacco, Inc. (JP) 2007-11-14 — — EP disclosed