SCHEMBL20740926

SCHEMBL20740926

CC(C)C[C@H](NC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NN

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 2/20 0.55
▸ MMP1 P03956 3/20 0.55
▸ MMP2 P08253 3/20 0.55
▸ MMP3 P08254 2/20 0.55
▸ KMT2A Q03164 1/20 0.54
▸ REN P00797 1/20 0.53
▸ PSMB5 P28074 4/20 0.52
▸ MMP8 P22894 3/20 0.52
▸ MMP9 P14780 2/20 0.51
▸ CTSL P07711 1/20 0.51
▸ FCER2 P06734 1/20 0.51
▸ MMP7 P09237 1/20 0.51

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
SCHEMBL20740927 1.00 MME (0.55) MMEMMP1MMP2MMP3KMT2A
SCHEMBL19547920 0.90 REN (0.49) MMEMMP1MMP2MMP3REN
SCHEMBL19547922 0.90 REN (0.49) MMEMMP1MMP2MMP3REN
SCHEMBL19547913 0.88 CTSL (0.58) MMEMMP1MMP2MMP3REN
SCHEMBL16571295 0.88 CTSL (0.58) MMEMMP1MMP2MMP3REN
SCHEMBL19547923 0.87 REN (0.48) MMEMMP1MMP2MMP3KMT2A
SCHEMBL19547924 0.87 REN (0.48) MMEMMP1MMP2MMP3KMT2A
SCHEMBL16571387 0.87 REN (0.48) MMEMMP1MMP2MMP3KMT2A
SCHEMBL19762064 0.87 KMT2A (0.55) MMEMMP1MMP2MMP3KMT2A
SCHEMBL19547930 0.85 REN (0.52) MMEMMP1MMP2MMP3REN

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-20190055283-A1 AZA-PEPTIDE ALDEHYDES AND KETONES OHIO STATE INNOVATION FOUNDATION 2019-02-21 — — 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-20190055283-A1 AZA-PEPTIDE ALDEHYDES AND KETONES VIP, DNPEP, PEPD MME 73/4885MMP1 55/4885MMP2 101/4885

“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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