SCHEMBL3137935

SCHEMBL3137935

CNC(Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(Cl)c(Cl)c1)C(=O)NCc1ccc(N)nc1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 16/20 0.53
KLK1 P06870 4/20 0.49
MASP2 O00187 1/20 0.44
FPR2 P25090 1/20 0.42
MMP1 P03956 1/20 0.42
FCER2 P06734 1/20 0.42

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
SCHEMBL3137925 1.00 KLKB1 (0.53) KLKB1KLK1MASP2FPR2MMP1
SCHEMBL3154156 0.91 KLKB1 (0.50) KLKB1KLK1
SCHEMBL1431801 0.91 KLKB1 (0.50) KLKB1KLK1
SCHEMBL1431700 0.90 KLKB1 (0.49) KLKB1KLK1MASP2FPR2MMP1
SCHEMBL3153048 0.90 KLKB1 (0.49) KLKB1KLK1MASP2FPR2MMP1
SCHEMBL1907929 0.90 KLKB1 (0.49) KLKB1KLK1MASP2FPR2MMP1
SCHEMBL3145480 0.88 KLKB1 (0.49) KLKB1KLK1MASP2FPR2FCER2
SCHEMBL1432280 0.88 KLKB1 (0.49) KLKB1KLK1MASP2FPR2FCER2
SCHEMBL3157823 0.88 MASP2 (0.44) KLKB1KLK1MASP2
SCHEMBL3157804 0.88 MASP2 (0.44) KLKB1KLK1MASP2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100076015-A1 Aminopyridine Derivatives VANTIA LIMITED (GB) 2010-03-25 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-20100076015-A1 Aminopyridine Derivatives CHRM1, ARG1, ARG2 KLKB1 3491/4885KLK1 3749/4885MASP2 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.