SCHEMBL3143598

SCHEMBL3143598

CCN(C)[C@@H](C)C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)NCc1ccc(N)nc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.44
MASP2 O00187 3/20 0.42
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
PSMB8 P28062 1/20 0.40
PSMB5 P28074 1/20 0.40
KLKB1 P03952 5/20 0.40
FURIN P09958 1/20 0.39
CTSS P25774 1/20 0.38
CTSK P43235 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MME P08473 1/20 0.38
ACE P12821 1/20 0.38
CPA1 P15085 1/20 0.38
ACE2 Q9BYF1 1/20 0.38
KLK1 P06870 1/20 0.38

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
SCHEMBL3143640 1.00 NAMPT (0.44) NAMPTMASP2KMT2AMEN1PSMB8
SCHEMBL3153185 0.93 NAMPT (0.42) NAMPTMASP2KMT2AMEN1PSMB8
SCHEMBL1432614 0.93 NAMPT (0.42) NAMPTMASP2KMT2AMEN1PSMB8
SCHEMBL3149793 0.92 NAMPT (0.44) NAMPTMASP2KMT2AMEN1PSMB8
SCHEMBL1432443 0.92 NAMPT (0.44) NAMPTMASP2KMT2AMEN1PSMB8
SCHEMBL3150256 0.92 MASP2 (0.41) NAMPTMASP2KMT2AMEN1PSMB8
SCHEMBL3150285 0.92 MASP2 (0.41) NAMPTMASP2KMT2AMEN1PSMB8
SCHEMBL3148409 0.91 KLKB1 (0.42) NAMPTMASP2KMT2AMEN1PSMB8
SCHEMBL3148388 0.91 KLKB1 (0.42) NAMPTMASP2KMT2AMEN1PSMB8
SCHEMBL1432647 0.90 NAMPT (0.46) NAMPTMASP2KMT2AMEN1PSMB8

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 NAMPT 1657/4885MASP2 3039/4885KMT2A 2435/4885

“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.