SCHEMBL30689111

SCHEMBL30689111

C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.51
ADORA2A P29274 1/20 0.51
ADORA2B P29275 1/20 0.51
ADORA1 P30542 1/20 0.51
CTRB1 P17538 1/20 0.49
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
CMA1 P23946 2/20 0.46
REN P00797 1/20 0.46
ELANE P08246 1/20 0.46
KLK7 P49862 1/20 0.46
NPSR1 Q6W5P4 1/20 0.45
TSHR P16473 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
GFER P55789 1/20 0.44
XIAP P98170 1/20 0.43
KLK5 Q9Y337 1/20 0.43
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL30689122 0.92 CTRB1 (0.48) ADORA3ADORA2AADORA2BADORA1CTRB1
SCHEMBL30689119 0.91 CTRB1 (0.56) CTRB1KMT2AMEN1CMA1REN
SCHEMBL30689107 0.91 CTRB1 (0.51) CTRB1KMT2AMEN1CMA1REN
SCHEMBL30689118 0.90 KMT2A (0.51) CTRB1KMT2AMEN1CMA1REN
SCHEMBL30689101 0.89 CTRB1 (0.55) CTRB1KMT2AMEN1CMA1ELANE
SCHEMBL30689117 0.88 CTRB1 (0.53) CTRB1KMT2AMEN1CMA1REN
SCHEMBL30689115 0.88 KMT2A (0.51) CTRB1KMT2AMEN1CMA1REN
SCHEMBL29535218 0.87 CTRB1 (0.58) CTRB1KMT2AMEN1CMA1KLK7
SCHEMBL30689099 0.86 ELANE (0.54) CTRB1KMT2AMEN1CMA1ELANE
SCHEMBL30689138 0.85 KMT2A (0.54) KMT2AMEN1CMA1NPSR1LMNA

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-20230312644-A1 COMPOUNDS HAVING TRIPLE ACTIVITIES OF THROMBOLYSIS, ANTITHROMBOTIC AND RADICAL SCAVENGING SHANGHAI LUMOSA THERAPEUTICS CO LTD (CN) 2023-10-05 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-20230312644-A1 COMPOUNDS HAVING TRIPLE ACTIVITIES OF THROMBOLYSIS, ANTITHROMBOTIC AND RADICAL SCAVENGING SERPINC1, PLAT, F2 ADORA3 308/4885ADORA2A 545/4885ADORA2B 449/4885

“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.