SCHEMBL6446543

SCHEMBL6446543

CC(C)(C)OC(=O)N1CCC(C#CCCCCl)CC1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 7/20 0.44
HPGD P15428 1/20 0.44
RECQL P46063 1/20 0.42
EPHX1 P07099 1/20 0.42
FAAH O00519 1/20 0.40
USP2 O75604 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39

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
SCHEMBL6450266 0.85 HPGD (0.47) GPR119HPGDRECQLEPHX1USP2
SCHEMBL6456079 0.82 HPGD (0.49) GPR119HPGDRECQLEPHX1USP2
SCHEMBL27120710 0.81 HPGD (0.48) GPR119HPGDRECQLEPHX1USP2
SCHEMBL6450758 0.79 GPR119 (0.43) GPR119HPGDRECQLEPHX1
SCHEMBL19059112 0.77 STS (0.51) GPR119SMN1; SMN2KEAP1NFE2L2
SCHEMBL12820311 0.77 HPGD (0.53) GPR119HPGDRECQLEPHX1USP2
SCHEMBL15203221 0.76 HPGD (0.51) GPR119HPGDRECQLEPHX1USP2
SCHEMBL6451175 0.75 GPR119 (0.43) GPR119HPGDRECQLEPHX1USP2
SCHEMBL6449345 0.75 RECQL (0.42) GPR119HPGDRECQLEPHX1USP2
SCHEMBL29059714 0.75 HPGD (0.50) GPR119HPGDRECQLEPHX1USP2

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 GPR119 30/4885HPGD 43/4885RECQL 3404/4885

“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.