SCHEMBL17744945

SCHEMBL17744945

CC(C)(C)NC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 1/20 0.59
▸ CYP17A1 P05093 2/20 0.52
▸ CD274 Q9NZQ7 1/20 0.49
▸ LMNA P02545 2/20 0.48
▸ MAPT P10636 1/20 0.48
▸ PSMB8 P28062 1/20 0.46
▸ USP2 O75604 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ HDAC6 Q9UBN7 2/20 0.45
▸ HDAC1 Q13547 1/20 0.45
▸ HDAC3 O15379 1/20 0.44
▸ HDAC11 Q96DB2 1/20 0.44
▸ HDAC8 Q9BY41 1/20 0.44
▸ NPC1 O15118 2/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ TP53 P04637 1/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL21661749 0.88 NAMPT (0.72) NAMPTCYP17A1CD274LMNAMAPT
SCHEMBL6640528 0.85 NAMPT (0.60) NAMPTCYP17A1CD274PSMB8HDAC6
SCHEMBL15451064 0.85 NAMPT (0.54) NAMPTCYP17A1CD274LMNAMAPT
SCHEMBL23099730 0.84 HDAC3 (0.47) NAMPTCD274LMNAMAPTKMT2A
SCHEMBL23666325 0.84 STAT3 (0.56) NAMPTLMNAMAPTKMT2AHDAC6
SCHEMBL13055402 0.84 CYP17A1 (0.59) NAMPTCYP17A1PSMB8SMN1; SMN2
SCHEMBL8770870 0.84 NAMPT (0.67) NAMPTCYP17A1CD274LMNAKMT2A
SCHEMBL8879852 0.84 NAMPT (0.59) NAMPTCYP17A1CD274LMNAMAPT
SCHEMBL8773493 0.84 NAMPT (0.67) NAMPTCYP17A1CD274MAPTKMT2A
SCHEMBL12637634 0.83 CYP17A1 (0.57) NAMPTCYP17A1CD274PSMB8NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160152579-A1 OXAZOLIDINONE DERIVATIVES AS PPAR LIGANDS SERVICIO ANDALUZ DE SALUD (ES) 2016-06-02 — — US disclosed
EP-3020710-A1 OXAZOLIDINONE DERIVATIVES AS PPAR LIGANDS Consejo Superior De Investigaciones Científicas (CSIC) (ES) 2016-05-18 — — EP 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-20160152579-A1 OXAZOLIDINONE DERIVATIVES AS PPAR LIGANDS PPARD, PPARG, PPARA NAMPT 2643/4885CYP17A1 1286/4885CD274 447/4885

“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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