SCHEMBL6449406

SCHEMBL6449406

C=CCN(C)CCOCCC1CCN(C(=O)OCC(C)C)CC1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LSS P48449 2/20 0.36
RAB9A P51151 1/20 0.34
ENPP2 Q13822 6/20 0.33
GPR119 Q8TDV5 2/20 0.33
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
TEAD1 P28347 1/20 0.33
TEAD3 Q99594 1/20 0.33
CHRM2 P08172 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM4 P08173 1/20 0.32
KIT P10721 1/20 0.31

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
SCHEMBL6449508 0.94 LSS (0.43) LSSRAB9AENPP2GPR119JAK2
SCHEMBL27596857 0.83 LSS (0.40) LSSTEAD1TEAD3
SCHEMBL7174776 0.83 HRH2 (0.39) RAB9AENPP2GPR119JAK2JAK1
SCHEMBL5035567 0.79 LSS (0.58) LSSRAB9AGPR119JAK2JAK1
SCHEMBL6450759 0.78 LSS (0.60) LSSRAB9A
SCHEMBL27596862 0.78 LSS (0.44) LSSGPR119TEAD1TEAD3
SCHEMBL6450100 0.77 GPR119 (0.35) LSSRAB9AENPP2GPR119JAK2
SCHEMBL6450314 0.77 LSS (0.44) LSSGPR119TEAD1TEAD3
SCHEMBL27596856 0.77 LSS (0.48) LSSTEAD1TEAD3
SCHEMBL5035561 0.74 LSS (0.53) LSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6964974-B2 2,3-oxidosqualene-lanosterol cyclase inhibitors HOFFMANN-LA ROCHE INC. (US) 2005-11-15 US disclosed
EP-1317432-A1 PIPERIDINE DERIVATIVES FOR USE AS 2,3-OXIDOSQUALENE-LANOSTEROL CYCLASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2003-06-11 EP disclosed
US-20020068753-A1 2,3-oxidosqualene-lanosterol cyclase inhibitors HOFFMANN-LA ROCHE INC. 2002-06-06 US disclosed
WO-2002020483-A1 PIPERIDINE DERIVATIVES FOR USE 2,3-OXIDOSQUALENE-LANOSTEROL CYCLASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2002-03-14 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-20020068753-A1 2,3-oxidosqualene-lanosterol cyclase inhibitors CYP51A1, LSS, CYP46A1 LSS 2/4885RAB9A 1392/4885ENPP2 569/4885

“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.