SCHEMBL5282037

SCHEMBL5282037

CC[C@@H](C)[C@H](NC(=O)C(Cc1ccc(C(F)(F)F)cc1)NC(=O)OC(C)(C)C)C(=O)N1CCCC1C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CMA1 P23946 14/20 0.57
▸ ACE P12821 1/20 0.56
▸ KMT2A Q03164 1/20 0.51
▸ REN P00797 2/20 0.48
▸ CTRC Q99895 1/20 0.46

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
SCHEMBL5282032 1.00 CMA1 (0.57) CMA1ACEKMT2ARENCTRC
SCHEMBL8103315 0.88 NTSR1 (0.49) CMA1
SCHEMBL5275753 0.84 DPP4 (0.51) CMA1ACEKMT2A
SCHEMBL5275743 0.84 DPP4 (0.51) CMA1ACEKMT2A
SCHEMBL8112052 0.83 CMA1 (0.47) CMA1
SCHEMBL10404192 0.81 CMA1 (0.53) CMA1ACEKMT2AREN
SCHEMBL5280818 0.81 CMA1 (0.53) CMA1ACEKMT2AREN
SCHEMBL10404191 0.81 CMA1 (0.53) CMA1ACEKMT2AREN
SCHEMBL8366869 0.80 CMA1 (0.52) CMA1ACEKMT2AREN
SCHEMBL22961962 0.80 ACE (0.72) CMA1ACEKMT2A

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
EP-1863804-A1 INHIBITORS OF HISTONE DEACETYLASE Methylgene, Inc. (CA) 2007-12-12 — — EP disclosed
US-20060264415-A1 Inhibitors of histone deacetylase METHYLGENE INC. 2006-11-23 — — US disclosed
WO-2006102760-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2006-10-05 — — 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-20060264415-A1 Inhibitors of histone deacetylase HDAC1, HDAC3, HDAC11 CMA1 1486/4885ACE 2939/4885KMT2A 30/4885

“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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