SCHEMBL2869013

SCHEMBL2869013

COc1ccnc(Nc2cccc(-c3cnc(C4CCC(=O)N4)s3)n2)c1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.43
SYK P43405 13/20 0.42
MAP3K12 Q12852 3/20 0.38
TRPV4 Q9HBA0 1/20 0.36
KARS1 Q15046 1/20 0.36

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
SCHEMBL2869006 1.00 KDR (0.43) KDRSYKMAP3K12TRPV4KARS1
SCHEMBL2862460 0.88 SYK (0.51) KDRSYKMAP3K12KARS1
SCHEMBL2862469 0.88 SYK (0.51) KDRSYKMAP3K12KARS1
SCHEMBL13136331 0.88 SYK (0.41) KDRSYKKARS1
SCHEMBL2871166 0.86 SYK (0.50) SYKMAP3K12KARS1
SCHEMBL2871174 0.86 SYK (0.50) SYKMAP3K12KARS1
SCHEMBL13136350 0.83 SYK (0.49) KDRSYKMAP3K12KARS1
SCHEMBL2862657 0.83 SYK (0.39) KDRSYKKARS1
SCHEMBL2862665 0.83 SYK (0.39) KDRSYKKARS1
SCHEMBL13136329 0.82 SYK (0.47) KDRSYK

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 5 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
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
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 KDR 1094/4885SYK 1/4885MAP3K12 798/4885

“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.