SCHEMBL1432964

SCHEMBL1432964

Nc1ccc(CNC(=O)[C@H](Cc2ccc(Cl)c(Cl)c2)NC(=O)[C@@H](N)c2ccccc2)cn1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 6/20 0.46
MASP2 O00187 3/20 0.44
KLK1 P06870 2/20 0.42
NAMPT P43490 2/20 0.41
FPR2 P25090 1/20 0.41
FCER2 P06734 2/20 0.40
MMP1 P03956 1/20 0.40
CTSB P07858 2/20 0.40
FNTA P49354 1/20 0.39
PGGT1B P53609 1/20 0.39

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
SCHEMBL1431903 1.00 KLKB1 (0.46) KLKB1MASP2KLK1NAMPTFPR2
SCHEMBL1431905 1.00 KLKB1 (0.46) KLKB1MASP2KLK1NAMPTFPR2
SCHEMBL1431700 0.89 KLKB1 (0.49) KLKB1MASP2KLK1FPR2FCER2
SCHEMBL3153048 0.89 KLKB1 (0.49) KLKB1MASP2KLK1FPR2FCER2
SCHEMBL1907929 0.87 KLKB1 (0.49) KLKB1MASP2KLK1NAMPTFPR2
SCHEMBL3149512 0.86 MASP2 (0.47) KLKB1MASP2KLK1NAMPTFPR2
SCHEMBL1431982 0.86 MASP2 (0.47) KLKB1MASP2KLK1NAMPTFPR2
SCHEMBL3137935 0.86 KLKB1 (0.53) KLKB1MASP2KLK1FPR2FCER2
SCHEMBL3137925 0.86 KLKB1 (0.53) KLKB1MASP2KLK1FPR2FCER2
SCHEMBL3149464 0.84 FURIN (0.45) KLKB1MASP2KLK1CTSB

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 KLKB1 3491/4885MASP2 3039/4885KLK1 3749/4885

“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.