SCHEMBL5828928

SCHEMBL5828928

CC1(O)CCN(S(=O)(=O)O)C1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.36
NAMPT P43490 1/20 0.33
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
JAK2 O60674 2/20 0.31
JAK3 P52333 2/20 0.31
JAK1 P23458 1/20 0.31
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
HIF1A Q16665 1/20 0.30

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
SCHEMBL24597201 0.83 ALDH1A1 (0.42) HSD11B1USP2ALDH1A1CYP3A4HPGD
SCHEMBL23581731 0.83 HSD11B1 (0.36) HSD11B1NAMPTUSP2ALDH1A1CYP3A4
SCHEMBL23341530 0.74 HSD11B1 (0.32) HSD11B1
SCHEMBL17970231 0.73 ALDH1A1 (0.44) HSD11B1USP2ALDH1A1CYP3A4HPGD
SCHEMBL23581752 0.72 HSD11B1 (0.34) HSD11B1NAMPT
SCHEMBL3410101 0.71 ALOX5AP (0.35) NAMPT
SCHEMBL17393808 0.70 HSD11B1 (0.53) HSD11B1NAMPTALDH1A1
SCHEMBL24597153 0.67 ALDH1A1 (0.32) USP2ALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL1487254 0.67 CA1 (0.36)
SCHEMBL5297767 0.67 CCR1 (0.33)

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-7101895-B2 Cyclohexyl sulphone derivatives as gamma-secretase inhibitors MERCK SHARP & DOHME LIMITED (GB) 2006-09-05 US disclosed
US-20040122050-A1 Cyclohexyl sulphone derivatives as gamma-secretase inhibitors MERCK SHARP & DOHME LTD. (GB) 2004-06-24 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-20040122050-A1 Cyclohexyl sulphone derivatives as gamma-secretase inhibitors BACE1, BACE2, APP HSD11B1 147/4885NAMPT 2124/4885USP2 1562/4885

“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.