SCHEMBL30948658

SCHEMBL30948658

CCCC(=O)N[C@@H](CCC(=O)C=[N+]=[N-])C(=O)OC(C)C

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.38
POLB P06746 1/20 0.38
FAAH O00519 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
NOD1 Q9Y239 4/20 0.33
PRSS1 P07477 1/20 0.31
CTSG P08311 1/20 0.31
CTRB1 P17538 1/20 0.31
CMA1 P23946 1/20 0.31
HDAC2 Q92769 1/20 0.31
ALDH1A1 P00352 1/20 0.30
PSMB5 P28074 1/20 0.30

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
SCHEMBL30948631 0.91 NOD1 (0.44) KMT2APOLBFAAHNOD1
SCHEMBL26940801 0.90 KMT2A (0.35) KMT2APOLBFAAHL3MBTL1ALDH1A1
SCHEMBL30682337 0.88 L3MBTL1 (0.35) KMT2APOLBFAAHL3MBTL1ALDH1A1
SCHEMBL26940811 0.88 KMT2A (0.34) KMT2APOLBFAAHL3MBTL1PSMB5
SCHEMBL26940616 0.88 L3MBTL1 (0.38) KMT2APOLBFAAHL3MBTL1
SCHEMBL30682213 0.88 L3MBTL1 (0.38) KMT2APOLBFAAHL3MBTL1
SCHEMBL30682192 0.86 L3MBTL1 (0.35) KMT2APOLBFAAHL3MBTL1
SCHEMBL26940827 0.86 L3MBTL1 (0.33) KMT2APOLBFAAHL3MBTL1HDAC2
SCHEMBL26940613 0.86 L3MBTL1 (0.33) KMT2APOLBFAAHL3MBTL1ALDH1A1
SCHEMBL26940805 0.86 L3MBTL1 (0.33) KMT2APOLBFAAHL3MBTL1HDAC2

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-20240246902-A1 PRODRUGS OF 6-DIAZO-5-OXO-L-NORLEUCINE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2024-07-25 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-20240246902-A1 PRODRUGS OF 6-DIAZO-5-OXO-L-NORLEUCINE GLUL, GLS, GLS2 KMT2A 1705/4885POLB 1467/4885FAAH 1065/4885

“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.