SCHEMBL4803196

SCHEMBL4803196

C=CCN(C)CCCCOC1CCC(N(C)S(=O)(=O)Cc2ccccc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.50
HPGD P15428 1/20 0.50
HSD17B10 Q99714 1/20 0.50
LSS P48449 16/20 0.46
MGLL Q99685 1/20 0.33

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
SCHEMBL4803204 1.00 USP2 (0.50) USP2HPGDHSD17B10LSSMGLL
SCHEMBL4797191 0.99 USP2 (0.49) USP2HPGDHSD17B10LSS
SCHEMBL4797182 0.99 USP2 (0.49) USP2HPGDHSD17B10LSS
SCHEMBL7210592 0.87 HPGD (0.53) USP2HPGDHSD17B10LSS
SCHEMBL7210589 0.87 HPGD (0.53) USP2HPGDHSD17B10LSS
SCHEMBL7206862 0.86 HPGD (0.52) USP2HPGDHSD17B10LSS
SCHEMBL7206868 0.86 HPGD (0.52) USP2HPGDHSD17B10LSS
SCHEMBL4798971 0.86 LSS (0.56) LSS
SCHEMBL4798967 0.86 LSS (0.56) LSS
SCHEMBL4803138 0.85 LSS (0.44) USP2HPGDHSD17B10LSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1311475-B1 AMINOCYCLOHEXANE DERIVATIVES HOFFMANN LA ROCHE (CH) 2008-08-06 EP disclosed
US-7335687-B2 2,3-Oxidosqualene-lanosterol cyclase inhibitors HOFFMANN-LA ROCHE INC. (US) 2008-02-26 US disclosed
US-20050176766-A1 2,3-Oxidosqualene-lanosterol cyclase inhibitors ACKERMANN JEAN (CH) 2005-08-11 US disclosed
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 (2 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-20050176766-A1 2,3-Oxidosqualene-lanosterol cyclase inhibitors CYP51A1, LSS, CYP46A1 USP2 2937/4885HPGD 128/4885HSD17B10 39/4885
US-20020045777-A1 2,3-oxidosqualene-lanosterol cyclase inhibitors CYP51A1, LSS, CYP46A1 USP2 2937/4885HPGD 128/4885HSD17B10 39/4885

“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.