SCHEMBL3149464

SCHEMBL3149464

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

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FURIN P09958 1/20 0.45
KLKB1 P03952 5/20 0.42
MASP2 O00187 3/20 0.41
KLK1 P06870 1/20 0.39
F7 P08709 1/20 0.39
TSHR P16473 1/20 0.38
HTRA1 Q92743 4/20 0.38
NFKB1 P19838 1/20 0.38
PSMB5 P28074 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
F11 P03951 1/20 0.37
CTSB P07858 1/20 0.36

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
SCHEMBL1432594 1.00 FURIN (0.45) FURINKLKB1MASP2KLK1F7
SCHEMBL1900645 0.87 KLKB1 (0.43) FURINKLKB1MASP2KLK1F7
SCHEMBL1900640 0.87 KLKB1 (0.43) FURINKLKB1MASP2KLK1F7
SCHEMBL1432471 0.86 KLKB1 (0.42) FURINKLKB1MASP2KLK1F7
SCHEMBL3154110 0.86 KLKB1 (0.42) FURINKLKB1MASP2KLK1F7
SCHEMBL3157804 0.85 MASP2 (0.44) FURINKLKB1MASP2KLK1F7
SCHEMBL3157823 0.85 MASP2 (0.44) FURINKLKB1MASP2KLK1F7
SCHEMBL3141397 0.85 KLKB1 (0.43) FURINKLKB1MASP2KLK1F7
SCHEMBL3141379 0.85 KLKB1 (0.43) FURINKLKB1MASP2KLK1F7
SCHEMBL1431768 0.85 KLKB1 (0.43) FURINKLKB1MASP2KLK1F7

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 FURIN 2416/4885KLKB1 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.