SCHEMBL2863631

SCHEMBL2863631

Cc1ccnc(Nc2cccc(-c3cnc(N4CCCC(C(=O)NCCO)C4)s3)n2)c1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KARS1 Q15046 4/20 0.49
SYK P43405 2/20 0.48
GPBAR1 Q8TDU6 3/20 0.45
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
MAPT P10636 6/20 0.42
THRB P10828 3/20 0.42
TP53 P04637 4/20 0.42
LMNA P02545 1/20 0.42
MAPK1 P28482 1/20 0.42
MAP3K12 Q12852 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL2866000 0.91 KARS1 (0.49) KARS1SYKMEN1KMT2AMAPT
SCHEMBL2858667 0.90 SYK (0.51) KARS1SYKKMT2ATP53MAP3K12
SCHEMBL2863599 0.88 SYK (0.56) KARS1SYKMAP3K12
SCHEMBL2868197 0.88 SYK (0.56) KARS1SYKMAP3K12
SCHEMBL2860457 0.88 SYK (0.52) KARS1SYKMAPTMAP3K12
SCHEMBL2868986 0.88 SYK (0.52) KARS1SYKMAPTMAP3K12
SCHEMBL2859404 0.86 KARS1 (0.48) KARS1SYKMAP3K12
SCHEMBL2859413 0.86 KARS1 (0.48) KARS1SYKMAP3K12
SCHEMBL13136536 0.85 SYK (0.51) KARS1SYKMAP3K12
SCHEMBL2868919 0.85 KARS1 (0.48) KARS1SYK

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 KARS1 2175/4885SYK 1/4885GPBAR1 1966/4885

“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.