SCHEMBL3635901

SCHEMBL3635901

CC(C)(C)OC(=O)N(CCO)CC(=O)Nc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 7/20 0.56
LMNA P02545 1/20 0.55
POLB P06746 1/20 0.55
MAPT P10636 1/20 0.55
HTT P42858 1/20 0.55
RAB9A P51151 4/20 0.54
SMN1; SMN2 Q16637 4/20 0.54
NPC1 O15118 3/20 0.54
ALDH1A1 P00352 2/20 0.54
NOX1 Q9Y5S8 2/20 0.49
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL6717933 0.89 LTA4H (0.58) LTA4HLMNAPOLBMAPTHTT
SCHEMBL13726322 0.86 LMNA (0.57) LTA4HLMNAPOLBMAPTHTT
SCHEMBL3823095 0.86 LTA4H (0.62) LTA4HLMNAPOLBMAPTHTT
SCHEMBL5314854 0.82 ALOX5 (0.53) LTA4H
SCHEMBL8302564 0.79 MEN1 (0.51) LTA4HLMNAMAPTRAB9ASMN1; SMN2
SCHEMBL2987817 0.77 RAB9A (0.74) LTA4HRAB9ASMN1; SMN2NPC1ALDH1A1
SCHEMBL24207746 0.76 L3MBTL1 (0.46) LMNAALDH1A1MEN1KMT2A
SCHEMBL25047613 0.76 LTA4H (0.53) LTA4H
SCHEMBL7857951 0.76 PSMB5 (0.46) LMNAPOLBMAPTHTTRAB9A
SCHEMBL7043590 0.76 LTA4H (0.62) LTA4HRAB9ASMN1; SMN2NPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150011759-A1 PROCESSES FOR PREPARING (R)-2-METHYLPYRROLIDINE AND (S)-2-METHYLPYRROLIDINE AND TARTRATE SALTS THEREOF CEPHALON, INC. (US) 2015-01-08 US disclosed
EP-2152669-A1 PROCESSES FOR PREPARING (R)-2-METHYLPYRROLIDINE AND (S)-2-METHYLPYRROLIDINE AND TARTRATE SALTS THEREOF Cephalon, Inc. (US) 2010-02-17 EP disclosed
EP-1904484-B1 COMPOUNDS GLAXO GROUP LTD (GB) 2009-08-26 EP disclosed
WO-2008137087-A1 PROCESSES FOR PREPARING (R)-2-METHYLPYRROLIDINE AND (S)-2-METHYLPYRROLIDINE AND TARTRATE SALTS THEREOF CEPHALON, INC. (US) 2008-11-13 WO disclosed
US-20080275027-A1 Piperazinone Derivatives Useful as Histamine H3 Receptor Antagonists and/or Inverse Agonists GLAXO GROUP LIMITED (GB) 2008-11-06 US disclosed
US-20080275027-A1 Piperazinone Derivatives Useful as Histamine H3 Receptor Antagonists and/or Inverse Agonists GLAXO GROUP LIMITED (GB) 2008-11-06 US disclosed
US-20080207638-A1 Compounds GLAXOSMITHKLINE ISTRAZIVACKI CENTER ZAGREB D.O.O (GB) 2008-08-28 US disclosed
US-20080207638-A1 Compounds GLAXOSMITHKLINE ISTRAZIVACKI CENTER ZAGREB D.O.O (GB) 2008-08-28 US disclosed
WO-2007009739-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2007-01-25 WO disclosed
WO-2007009741-A1 PIPERAZINONE DERIVATIVES USEFUL AS HISTAMINE H3 RECEPTOR ANTAGONISTS AND/OR INVERSE AGONISTS GLAXO GROUP LIMITED (GB) 2007-01-25 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 (3 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-20080207638-A1 Compounds CMA1, MRGPRX2, HRH2 LTA4H 21/4885LMNA 2529/4885POLB 3167/4885
US-20150011759-A1 PROCESSES FOR PREPARING (R)-2-METHYLPYRROLIDINE AND (S)-2-METHYLPYRROLIDINE AND TARTRATE SALTS THEREOF TPMT, SPR, QDPR LTA4H 4357/4885LMNA 4225/4885POLB 799/4885
US-20080275027-A1 Piperazinone Derivatives Useful as Histamine H3 Receptor Antagonists and/or Inverse Agonists HRH3, HRH1, HRH4 LTA4H 204/4885LMNA 3821/4885POLB 2494/4885

“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.