SCHEMBL6749693

SCHEMBL6749693

CC(O)C(C)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MDM4 O15151 2/20 0.51
▸ TP53 P04637 2/20 0.51
▸ CASP3 P42574 3/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ EPHX2 P34913 1/20 0.46
▸ FABP7 O15540 1/20 0.45
▸ FABP5 Q01469 1/20 0.45

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
SCHEMBL19639090 0.91 KMT2A (0.50) MDM4TP53CASP3KMT2AEPHX2
SCHEMBL14957217 0.91 KMT2A (0.50) MDM4TP53CASP3KMT2AEPHX2
SCHEMBL14761328 0.91 KMT2A (0.50) MDM4TP53CASP3KMT2AEPHX2
SCHEMBL30963634 0.91 KMT2A (0.50) MDM4TP53CASP3KMT2AEPHX2
SCHEMBL23743060 0.88 KMT2A (0.47) MDM4TP53CASP3KMT2AEPHX2
SCHEMBL30150322 0.88 KMT2A (0.47) MDM4TP53CASP3KMT2AEPHX2
SCHEMBL22636287 0.88 KMT2A (0.47) MDM4TP53CASP3KMT2AEPHX2
SCHEMBL22636286 0.88 KMT2A (0.47) MDM4TP53CASP3KMT2AEPHX2
SCHEMBL31681813 0.88 KMT2A (0.47) MDM4TP53CASP3KMT2AEPHX2
SCHEMBL6752346 0.87 KMT2A (0.46) MDM4TP53CASP3KMT2AEPHX2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040127549-A1 Cyclic 2-carbonylaminoketones as inhibitors of cruzipain and other cysteine proteases AMURA THERAPEUTICS LIMITED (GB) 2004-07-01 — — US disclosed
EP-1362042-A1 CYCLIC 2-CARBONYLAMINOKETONES AS INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES Amura Therapeutics Limited (GB) 2003-11-19 — — EP disclosed
WO-2002057249-A1 CYCLIC 2-CARBONYLAMINOKETONES AS INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES AMURA THERAPEUTICS LIMITED (GB) 2002-07-25 — — WO 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-20040127549-A1 Cyclic 2-carbonylaminoketones as inhibitors of cruzipain and other cysteine proteases CPN1, CTRL, CPA1 MDM4 4820/4885TP53 3988/4885CASP3 1383/4885

“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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