SCHEMBL14353177

SCHEMBL14353177

CC(C)(C)OC(=O)NCCc1ccc(-c2ccc(=O)[nH]c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.49
▸ CA2 P00918 3/20 0.47
▸ CA1 P00915 2/20 0.47
▸ NAMPT P43490 1/20 0.47
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ IDO1 P14902 3/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ PTGER4 P35408 1/20 0.44
▸ AKT1 P31749 1/20 0.43
▸ GPR119 Q8TDV5 1/20 0.41
▸ OPRM1 P35372 3/20 0.41
▸ OPRD1 P41143 1/20 0.41
▸ OPRK1 P41145 1/20 0.41
▸ MAPT P10636 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ CYP17A1 P05093 1/20 0.40
▸ HRH3 Q9Y5N1 1/20 0.40

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
SCHEMBL31248761 0.87 L3MBTL1 (0.52) CA2CA1NAMPTMEN1KMT2A
SCHEMBL18800977 0.81 NAMPT (0.58) CA2CA1NAMPTIDO1AKT1
SCHEMBL20208983 0.80 CA2 (0.55) LMNACA2CA1NAMPTIDO1
SCHEMBL5266340 0.80 TDP1 (0.50) CA2CA1MEN1KMT2AMAPT
SCHEMBL14353181 0.80 L3MBTL1 (0.56) LMNAMEN1KMT2AL3MBTL1OPRM1
SCHEMBL23291128 0.79 CYP17A1 (0.59) LMNACA2CA1NAMPTPTGER4
SCHEMBL4465651 0.78 MGLL (0.51) LMNACA2CA1NAMPTKMT2A
SCHEMBL19502096 0.78 CYP17A1 (0.53) CA1NAMPTGPR119CYP17A1
SCHEMBL29773322 0.77 BRD4 (0.52) MEN1KMT2AL3MBTL1
SCHEMBL20208984 0.77 CTSS (0.50) CA2CA1NAMPTPTGER4AKT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9415045-B2 Peripherally acting opioid compounds ALKERMES, INC. (US) 2016-08-16 — — US disclosed
US-20150196550-A1 Peripherally Acting Opioid Compounds ALKERMES INC (US) 2015-07-16 — — US disclosed
US-8962646-B2 Peripherally acting opioid compounds ALKERMES, INC. (US) 2015-02-24 — — US disclosed
EP-2725908-A1 PERIPHERALLY ACTING OPIOID COMPOUNDS Alkermes, Inc. (US) 2014-05-07 — — EP disclosed
WO-2013003720-A1 PERIPHERALLY ACTING OPIOID COMPOUNDS ALKERMES, INC. (US) 2013-01-03 — — WO disclosed
US-20130005755-A1 Peripherally Acting Opioid Compounds ALKERMES, INC. 2013-01-03 — — 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 (2 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-20150196550-A1 Peripherally Acting Opioid Compounds OPRM1, OPRK1, OPRL1 LMNA 4277/4885CA2 3951/4885CA1 3479/4885
US-20130005755-A1 Peripherally Acting Opioid Compounds OPRM1, OPRK1, OPRL1 LMNA 4277/4885CA2 3951/4885CA1 3479/4885

“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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