SCHEMBL3155287

SCHEMBL3155287

CCCCN(C)CC(=O)NC(Cc1ccc(F)c(F)c1)C(=O)NCc1ccc(N)nc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 1/20 0.39
▸ FURIN P09958 1/20 0.39
▸ PDPK1 O15530 1/20 0.38
▸ MASP2 O00187 1/20 0.36
▸ CHRND Q07001 5/20 0.36
▸ CHRNA1 P02708 1/20 0.36
▸ CHRNG P07510 1/20 0.36
▸ CHRNB1 P11230 1/20 0.36
▸ NAMPT P43490 1/20 0.36
▸ PSMB1 P20618 1/20 0.36
▸ PSMB5 P28074 1/20 0.36
▸ PSMB2 P49721 1/20 0.36
▸ GRIA1 P42261 2/20 0.35
▸ HTRA1 Q92743 2/20 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
SCHEMBL3155267 1.00 KLKB1 (0.39) KLKB1FURINPDPK1MASP2CHRND
SCHEMBL1432936 0.89 KLKB1 (0.41) KLKB1FURINPDPK1MASP2CHRND
SCHEMBL1432942 0.89 KLKB1 (0.41) KLKB1FURINPDPK1MASP2CHRND
SCHEMBL1432049 0.88 KLKB1 (0.43) KLKB1MASP2NAMPTPSMB1PSMB5
SCHEMBL1432044 0.88 KLKB1 (0.43) KLKB1MASP2NAMPTPSMB1PSMB5
SCHEMBL1431799 0.88 PSMB1 (0.40) KLKB1FURINPDPK1MASP2NAMPT
SCHEMBL1431793 0.88 PSMB1 (0.40) KLKB1FURINPDPK1MASP2NAMPT
SCHEMBL3139156 0.87 KLKB1 (0.42) KLKB1FURINPDPK1MASP2NAMPT
SCHEMBL3139166 0.87 KLKB1 (0.42) KLKB1FURINPDPK1MASP2NAMPT
SCHEMBL1432205 0.87 KLKB1 (0.42) KLKB1FURINPDPK1MASP2NAMPT

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 3491/4885FURIN 2416/4885PDPK1 1972/4885

“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.

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