SCHEMBL3149672

SCHEMBL3149672

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

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 6/20 0.40
MASP2 O00187 3/20 0.39
F7 P08709 1/20 0.38
FURIN P09958 1/20 0.38
NAMPT P43490 2/20 0.37
KLK1 P06870 2/20 0.37
F11 P03951 1/20 0.37
F2 P00734 2/20 0.36
F10 P00742 1/20 0.36
TSHR P16473 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL3149688 1.00 KLKB1 (0.40) KLKB1MASP2F7FURINNAMPT
SCHEMBL3148667 0.90 KLKB1 (0.41) KLKB1MASP2F7FURINNAMPT
SCHEMBL3149326 0.90 KLKB1 (0.41) KLKB1MASP2F7FURINNAMPT
SCHEMBL3148655 0.90 KLKB1 (0.41) KLKB1MASP2F7FURINNAMPT
SCHEMBL13416201 0.89 KLKB1 (0.39) KLKB1MASP2F7FURINNAMPT
SCHEMBL3149682 0.85 MASP2 (0.43) KLKB1MASP2F7FURINNAMPT
SCHEMBL3141379 0.85 KLKB1 (0.43) KLKB1MASP2F7FURINKLK1
SCHEMBL3141397 0.85 KLKB1 (0.43) KLKB1MASP2F7FURINKLK1
SCHEMBL1431904 0.85 MASP2 (0.40) KLKB1MASP2F7FURINNAMPT
SCHEMBL1431907 0.85 MASP2 (0.40) KLKB1MASP2F7FURINNAMPT

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 3491/4885MASP2 3039/4885F7 4272/4885

“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.