SCHEMBL24964895

SCHEMBL24964895

CCN(C(C(=O)N[C@@H](CC(=O)O)C(=O)N1CCCC1)C(C)C)S(=O)(=O)c1ccccc1[N+](=O)[O-]

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.40
TDP1 Q9NUW8 1/20 0.40
MEN1 O00255 3/20 0.38
ALDH1A1 P00352 3/20 0.38
NPSR1 Q6W5P4 2/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
MCOLN3 Q8TDD5 1/20 0.37
MAPT P10636 1/20 0.37
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP9 P14780 1/20 0.36
MMP8 P22894 1/20 0.36
MMP14 P50281 1/20 0.36
HTT P42858 1/20 0.36
PKM P14618 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
SCHEMBL24965923 0.94 KMT2A (0.39) KMT2ATDP1MEN1ALDH1A1NPSR1
SCHEMBL24963386 0.85 KMT2A (0.40) KMT2ATDP1MEN1ALDH1A1NPSR1
SCHEMBL24964932 0.83 THRB (0.36) KMT2ATDP1MEN1ALDH1A1MMP1
SCHEMBL24964934 0.81 ADAMTS4 (0.42) KMT2ATDP1MEN1ALDH1A1MMP1
SCHEMBL24963317 0.79 ALDH1A1 (0.34) KMT2ATDP1MEN1ALDH1A1NPSR1
SCHEMBL31220617 0.77 MEN1 (0.50) KMT2AMEN1NPSR1
SCHEMBL19243561 0.70
SCHEMBL6280894 0.68 KMT2A (0.45) KMT2ATDP1MEN1ALDH1A1NPSR1
SCHEMBL6280897 0.68 KMT2A (0.45) KMT2ATDP1MEN1ALDH1A1NPSR1
SCHEMBL3202545 0.68 PKM (0.47) KMT2AMEN1ALDH1A1NPSR1MMP1

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-20230026641-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND COMPRISING HIGHLY STERICALLY HINDERED AMINO ACID CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-01-26 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-20230026641-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND COMPRISING HIGHLY STERICALLY HINDERED AMINO ACID DNPEP, VIP, NPEPPS KMT2A 2469/4885TDP1 4557/4885MEN1 583/4885

“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.