SCHEMBL3148057

SCHEMBL3148057

C[C@@H](C(=O)N[C@@H](C(=O)NCc1ccc(N)nc1)C(C1CCCCC1)C1CCCCC1)N(C)C

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MASP2 O00187 3/20 0.43
CYP3A4 P08684 1/20 0.37
CPB2 Q96IY4 6/20 0.36
PPIB P23284 1/20 0.36
CPB1 P15086 2/20 0.36
EPHX1 P07099 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
KIT P10721 1/20 0.35
MAPK14 Q16539 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
TP53 P04637 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL3148062 1.00 MASP2 (0.43) MASP2CYP3A4CPB2PPIBCPB1
SCHEMBL3149186 0.93 MASP2 (0.42) MASP2CYP3A4CPB2PPIBCPB1
SCHEMBL3149202 0.93 MASP2 (0.42) MASP2CYP3A4CPB2PPIBCPB1
SCHEMBL1431929 0.87 MASP2 (0.46) MASP2CYP3A4CPB2PPIBCPB1
SCHEMBL3139463 0.87 MASP2 (0.46) MASP2CYP3A4CPB2PPIBCPB1
SCHEMBL1431843 0.86 MASP2 (0.43) MASP2CYP3A4CPB2PPIBCPB1
SCHEMBL1431832 0.86 MASP2 (0.43) MASP2CYP3A4CPB2PPIBCPB1
SCHEMBL1906142 0.86 MASP2 (0.42) MASP2CYP3A4CPB2PPIBCPB1
SCHEMBL1432550 0.86 MASP2 (0.42) MASP2CYP3A4CPB2PPIBCPB1
SCHEMBL1432547 0.86 MASP2 (0.42) MASP2CYP3A4CPB2PPIBCPB1

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 MASP2 3039/4885CYP3A4 307/4885CPB2 2005/4885

“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.