SCHEMBL2869607

SCHEMBL2869607

CC(=O)N[C@@H](C)c1ncc(-c2cccc(Nc3cc4ccccc4cn3)n2)s1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP3K5 Q99683 2/20 0.42
MAP3K7 O43318 1/20 0.42
MAP3K6 O95382 1/20 0.42
SYK P43405 7/20 0.39
ACACB O00763 4/20 0.37
ACACA Q13085 4/20 0.37
JAK1 P23458 1/20 0.36
TYK2 P29597 1/20 0.36
CHEK1 O14757 1/20 0.35
KARS1 Q15046 1/20 0.34
NPC1 O15118 1/20 0.34
MAPT P10636 1/20 0.34
NFKB1 P19838 1/20 0.34
RAB9A P51151 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NOTUM Q6P988 1/20 0.33
SCN9A Q15858 1/20 0.33
MTOR P42345 1/20 0.33

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
SCHEMBL2859100 0.85 KARS1 (0.52) SYKKARS1NPC1MAPTRAB9A
SCHEMBL13136082 0.84 KDR (0.46) SYKACACBKARS1
SCHEMBL2861389 0.84 SYK (0.52) SYKACACBACACAJAK1TYK2
SCHEMBL13136237 0.84 SYK (0.41) SYKACACBACACAKARS1NPC1
SCHEMBL2863845 0.82 KARS1 (0.42) SYKKARS1NPC1MAPTNFKB1
SCHEMBL13136087 0.82 ACACB (0.44) SYKACACBACACA
SCHEMBL13136326 0.81 SYK (0.46) SYKKARS1
SCHEMBL13136228 0.81 SYK (0.43) SYKACACBACACAKARS1
SCHEMBL13136196 0.79 SYK (0.39) SYKACACBACACAKARS1
SCHEMBL13136324 0.78 SYK (0.46) SYKJAK1TYK2KARS1NPC1

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 8 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 claimed
EP-1854793-A1 NOVEL AMINOPYRIDINE COMPOUND WITH Syk INHIBITORY ACTIVITY Japan Tobacco, Inc. (JP) 2007-11-14 EP claimed
US-20060205731-A1 Novel aminopyridine compounds having Syk inhibitory activity JAPAN TOBACCO INC. (JP) 2006-09-14 US claimed
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
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
US-20060205731-A1 Novel aminopyridine compounds having Syk inhibitory activity JAPAN TOBACCO INC. (JP) 2006-09-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060205731-A1 Novel aminopyridine compounds having Syk inhibitory activity SYK, BTK, ZAP70 MAP3K5 470/4885MAP3K7 759/4885MAP3K6 628/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.