SCHEMBL24964932

SCHEMBL24964932

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

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.36
MMP1 P03956 2/20 0.35
MMP2 P08253 2/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35
MMP13 P45452 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TDP1 Q9NUW8 3/20 0.35
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
KMT2A Q03164 2/20 0.34
MMP14 P50281 1/20 0.34
HTT P42858 2/20 0.34
GAA P10253 2/20 0.34
HPGD P15428 1/20 0.34
PKM P14618 1/20 0.34
MEN1 O00255 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
SCHEMBL24963386 0.88 KMT2A (0.40) SMN1; SMN2TDP1ALDH1A1KMT2AHTT
SCHEMBL24964895 0.83 KMT2A (0.40) MMP1MMP2MMP9MMP8TDP1
SCHEMBL24965923 0.82 KMT2A (0.39) MMP1MMP2CA1MMP9MMP8
SCHEMBL24964934 0.81 ADAMTS4 (0.42) THRBMMP1MMP2CA1CA2
SCHEMBL24964897 0.77 RRM1 (0.39)
SCHEMBL24964898 0.77 RRM1 (0.39)
SCHEMBL29709630 0.75 MMP9 (0.41) MMP1MMP2CA1CA2MMP9
SCHEMBL24965156 0.75 RRM1 (0.36)
SCHEMBL24965154 0.75 RRM1 (0.36)
SCHEMBL24964928 0.74 RRM1 (0.40) MMP1MMP2MMP8

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 THRB 861/4885MMP1 3245/4885MMP2 2333/4885

“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.