SCHEMBL6528893

SCHEMBL6528893

CC(CCCOC1CCC(CNS(=O)(=O)c2ccc(C(F)(F)F)cc2)CC1)N(C)C

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
HPGD P15428 2/20 0.40
HTT P42858 1/20 0.40
ALDH1A1 P00352 7/20 0.40
GBA1 P04062 1/20 0.39
LMNA P02545 2/20 0.39
MGLL Q99685 1/20 0.39
GAA P10253 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HDAC4 P56524 1/20 0.38
NPC1 O15118 1/20 0.38
TGFBR1 P36897 1/20 0.38
USP30 Q70CQ3 1/20 0.38
CNR2 P34972 2/20 0.38
CNR1 P21554 1/20 0.38
CYP19A1 P11511 1/20 0.38
CYP2C9 P11712 1/20 0.38

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
SCHEMBL7204735 0.86 CA1 (0.43) CA1CA2HPGDHTTALDH1A1
SCHEMBL4804897 0.82 HTR2A (0.51) USP30
SCHEMBL4804891 0.82 HTR2A (0.51) USP30
SCHEMBL7211522 0.82 USP30 (0.44) CA1CA2HPGDHTTALDH1A1
SCHEMBL5070017 0.82 LSS (0.45) CA1CA2HPGDHTTALDH1A1
SCHEMBL7205051 0.81 LSS (0.46) HPGDHTTALDH1A1GBA1LMNA
SCHEMBL5092120 0.80 LSS (0.46) HPGDHTTALDH1A1GBA1LMNA
SCHEMBL7205305 0.80 HPGD (0.47) CA1CA2HPGDHTTALDH1A1
SCHEMBL7203923 0.80 CNR2 (0.47) CA1CA2HPGDHTTALDH1A1
SCHEMBL7209261 0.78 LSS (0.46) HPGDHTTALDH1A1GBA1LMNA

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-6858651-B2 2,3-oxidosqualene-lanosterol cyclase inhibitors HOFFMANN-LA ROCHE INC. (US) 2005-02-22 US disclosed
US-20020045777-A1 2,3-oxidosqualene-lanosterol cyclase inhibitors F.HOFFMANN-LA ROCHE AG (CH) 2002-04-18 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-20020045777-A1 2,3-oxidosqualene-lanosterol cyclase inhibitors CYP51A1, LSS, CYP46A1 CA1 2475/4885CA2 2022/4885HPGD 128/4885

“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.