SCHEMBL6446616

SCHEMBL6446616

CN(CCCCCOC1CCN(C(=O)Cc2ccc(F)cc2)CC1)C1CC1

nearest known ligand 0.74

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LSS P48449 5/20 0.74
MLNR O43193 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
CYP3A4 P08684 2/20 0.41
PKM P14618 2/20 0.41
ME2 P23368 1/20 0.40
ME1 P48163 1/20 0.40
ME3 Q16798 1/20 0.40
MAPT P10636 1/20 0.39
ALOX12 P18054 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
SCHEMBL6450181 0.87 LSS (0.56) LSSMLNRSMN1; SMN2ALDH1A1POLB
SCHEMBL6447847 0.86 LSS (0.57) LSSMLNRSMN1; SMN2ALDH1A1POLB
SCHEMBL17358777 0.85 LSS (1.00) LSSSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL6451232 0.84 LSS (0.76) LSSMLNRSMN1; SMN2ALDH1A1POLB
SCHEMBL6446618 0.78 LSS (0.46) LSSMLNRSMN1; SMN2ALDH1A1POLB
SCHEMBL7141801 0.75 LSS (0.62) LSS
SCHEMBL27498732 0.74 LSS (0.60) LSSSMN1; SMN2ALDH1A1L3MBTL1MAPT
SCHEMBL7206605 0.73 LSS (0.50) LSSSMN1; SMN2ALDH1A1POLBCYP3A4
SCHEMBL7206600 0.73 LSS (0.50) LSSSMN1; SMN2ALDH1A1POLBCYP3A4
SCHEMBL5045773 0.73 LSS (0.61) LSSALDH1A1POLBL3MBTL1ME2

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 2 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
US-20020068753-A1 2,3-oxidosqualene-lanosterol cyclase inhibitors HOFFMANN-LA ROCHE INC. 2002-06-06 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 (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 2/4885MLNR 3309/4885SMN1; SMN2 4781/4885

“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.