SCHEMBL4019747

SCHEMBL4019747

CN(CCCCCCCC=O)Cc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.65
ACHE P22303 5/20 0.55
MAOB P27338 4/20 0.55
MAOA P21397 1/20 0.54
KDM4A O75164 2/20 0.52
KDM4C Q9H3R0 2/20 0.52
CARM1 Q86X55 1/20 0.51
PRMT6 Q96LA8 1/20 0.51
PRMT8 Q9NR22 1/20 0.51
HTR7 P34969 2/20 0.50
APP P05067 1/20 0.49

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
SCHEMBL24504977 0.98 SIGMAR1 (0.62) SIGMAR1ACHEMAOBMAOAKDM4A
SCHEMBL7937668 0.86 CARM1 (0.58) SIGMAR1ACHEMAOBMAOACARM1
SCHEMBL29733117 0.86 SIGMAR1 (0.85) SIGMAR1ACHEMAOBMAOAKDM4A
SCHEMBL7225346 0.86 SIGMAR1 (0.85) SIGMAR1ACHEMAOBMAOAKDM4A
SCHEMBL15362878 0.83 SIGMAR1 (0.65) SIGMAR1ACHEMAOBMAOAKDM4A
SCHEMBL15336537 0.83 SIGMAR1 (0.65) SIGMAR1ACHEMAOBMAOAKDM4A
SCHEMBL1449848 0.83 HDAC3 (0.54) SIGMAR1ACHEMAOB
SCHEMBL1449161 0.83 HDAC3 (0.54) SIGMAR1ACHEMAOB
SCHEMBL4330336 0.81 HDAC3 (0.53) ACHEMAOB
SCHEMBL9136021 0.81 SIGMAR1 (0.61) SIGMAR1ACHEMAOBMAOAKDM4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3221293-B1 IONIZABLE CATIONIC LIPID FOR RNA DELIVERY ARCTURUS THERAPEUTICS INC (US) 2023-03-01 EP disclosed
US-7638639-B2 Substituted pyrrolidine and related compounds THERAVANCE, INC. (US) 2009-12-29 US disclosed
US-7615566-B2 Substituted pyrrolidine and related compounds THERAVANCE, INC. (US) 2009-11-10 US disclosed
US-7524880-B2 Crystalline form of a substituted pyrrolidine compound THERAVANCE, INC. (US) 2009-04-28 US disclosed
US-20080161577-A1 Substituted pyrrolidine and related compounds THERAVANCE BIOPHARMA R&D IP, LLC 2008-07-03 US disclosed
US-20080146649-A1 Substituted pyrrolidine and related compounds THERAVANCE BIOPHARMA R&D IP, LLC 2008-06-19 US disclosed
US-7351718-B2 Substituted pyrrolidine and related compounds THERAVANCE, INC. (US) 2008-04-01 US disclosed
US-7351717-B2 Substituted pyrrolidine and related compounds THERAVANCE, INC. (US) 2008-04-01 US disclosed
US-20070135482-A1 Substituted pyrrolidine and related compounds THERAVANCE BIOPHARMA R&D IP, LLC 2007-06-14 US disclosed
US-20070078163-A1 Substituted pyrrolidine and related compounds THERAVANCE BIOPHARMA R&D IP, LLC 2007-04-05 US disclosed
US-7183292-B2 Substituted pyrrolidine and related compounds THERAVANCE, INC. (US) 2007-02-27 US disclosed
US-20050277688-A1 Crystalline form of a substituted pyrrolidine compound THERAVANCE, INC. 2005-12-15 US disclosed
US-20040254219-A1 Substituted pyrrolidine and related compounds THERAVANCE BIOPHARMA R&D IP, LLC 2004-12-16 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 (6 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-20070135482-A1 Substituted pyrrolidine and related compounds CHRM1, CHRM5, CHRM2 SIGMAR1 264/4885ACHE 288/4885MAOB 572/4885
US-20050277688-A1 Crystalline form of a substituted pyrrolidine compound PKD2, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, PKD1 SIGMAR1 1865/4885ACHE 4701/4885MAOB 4706/4885
US-20080161577-A1 Substituted pyrrolidine and related compounds CHRM1, CHRM5, CHRM2 SIGMAR1 264/4885ACHE 288/4885MAOB 572/4885
US-20040254219-A1 Substituted pyrrolidine and related compounds CHRM1, CHRM5, ADRA1D SIGMAR1 151/4885ACHE 388/4885MAOB 961/4885
US-20080146649-A1 Substituted pyrrolidine and related compounds CHRM1, CHRM5, CHRM2 SIGMAR1 264/4885ACHE 288/4885MAOB 572/4885
US-20070078163-A1 Substituted pyrrolidine and related compounds CHRM1, CHRM5, CHRM2 SIGMAR1 264/4885ACHE 288/4885MAOB 572/4885

“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.