SCHEMBL1431917

SCHEMBL1431917

NCC(=O)N[C@@H](CC1CCCC2CCCCC21)C(=O)NCc1ccc(N)nc1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PSMB10 P40306 2/20 0.40
▸ PSMB2 P49721 2/20 0.40
▸ MASP2 O00187 3/20 0.40
▸ FURIN P09958 1/20 0.37
▸ CPB2 Q96IY4 6/20 0.35
▸ CPB1 P15086 2/20 0.35
▸ F2 P00734 1/20 0.34
▸ F10 P00742 1/20 0.34
▸ F2RL1 P55085 2/20 0.34
▸ TLR2 O60603 1/20 0.34

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
SCHEMBL1431923 1.00 PSMB10 (0.40) PSMB10PSMB2MASP2FURINCPB2
SCHEMBL1903263 0.92 MASP2 (0.40) PSMB10PSMB2MASP2FURINCPB2
SCHEMBL1903269 0.92 MASP2 (0.40) PSMB10PSMB2MASP2FURINCPB2
SCHEMBL1907760 0.90 PSMB10 (0.41) PSMB10PSMB2MASP2FURINCPB2
SCHEMBL1432775 0.90 PSMB10 (0.39) PSMB10PSMB2MASP2FURINCPB2
SCHEMBL1907759 0.90 PSMB10 (0.41) PSMB10PSMB2MASP2FURINCPB2
SCHEMBL3141239 0.90 PSMB10 (0.39) PSMB10PSMB2MASP2FURINCPB2
SCHEMBL1902808 0.89 MAPK1 (0.40) PSMB10PSMB2MASP2CPB2CPB1
SCHEMBL1432229 0.88 MASP2 (0.43) PSMB10PSMB2MASP2FURINCPB2
SCHEMBL1907930 0.88 MASP2 (0.41) PSMB10PSMB2MASP2FURINCPB2

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
EP-2300428-A1 AMINOPYRIDINE DERIVATIVES Vantia Limited (GB) 2011-03-30 — — EP disclosed
US-20100076015-A1 Aminopyridine Derivatives VANTIA LIMITED (GB) 2010-03-25 — — US disclosed
WO-2009133348-A1 AMINOPYRIDINE DERIVATIVES VANTIA LIMITED (GB) 2009-11-05 — — WO 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-20100076015-A1 Aminopyridine Derivatives CHRM1, ARG1, ARG2 PSMB10 2852/4885PSMB2 2867/4885MASP2 3039/4885

“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.

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