SCHEMBL3149506

SCHEMBL3149506

Cc1nc(N)ccc1CNC(=O)[C@@H](N)Cc1cccc(Cl)c1

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F2 P00734 16/20 0.59
KLKB1 P03952 1/20 0.46
MASP2 O00187 3/20 0.46
PRSS1 P07477 1/20 0.44

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
SCHEMBL3157747 1.00 F2 (0.59) F2KLKB1MASP2PRSS1
SCHEMBL3157648 0.89 F2 (0.57) F2KLKB1MASP2PRSS1
SCHEMBL3154741 0.86 F2 (0.58) F2KLKB1MASP2
SCHEMBL3149590 0.86 F2 (0.58) F2KLKB1MASP2
SCHEMBL3157965 0.85 F2 (0.60) F2MASP2PRSS1
SCHEMBL3140046 0.84 F2 (0.49) F2MASP2
SCHEMBL3139987 0.80 F2 (0.56) F2KLKB1MASP2
SCHEMBL4306897 0.80 F2 (0.51) F2KLKB1MASP2
SCHEMBL4308027 0.80 F2 (0.51) F2KLKB1MASP2
SCHEMBL3144724 0.79 MASP2 (0.46) MASP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 F2 1046/4885KLKB1 3491/4885MASP2 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.