SCHEMBL6242557

SCHEMBL6242557

CCCS(=O)(=O)NC1CCCC=C1c1ccc(OCCNS(C)(=O)=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
HTT P42858 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
LMNA P02545 1/20 0.37
PKM P14618 2/20 0.36
SLC6A9 P48067 2/20 0.35
KDM4E B2RXH2 2/20 0.34
DYRK3 O43781 1/20 0.34
ROCK2 O75116 1/20 0.34
PRKD3 O94806 1/20 0.34
MAP4K4 O95819 1/20 0.34
CDK1 P06493 1/20 0.34
ROS1 P08922 1/20 0.34
PIM1 P11309 1/20 0.34
PRKACA P17612 1/20 0.34
RPS6KB1 P23443 1/20 0.34

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
SCHEMBL6241888 0.94 CYP1A2 (0.39) ALDH1A1HTTMEN1KMT2ACYP1A2
SCHEMBL6242490 0.94 ALDH1A1 (0.47) ALDH1A1HTTMEN1KMT2ACYP1A2
SCHEMBL6242859 0.88 SLC6A9 (0.40) ALDH1A1HTTMEN1KMT2ACYP1A2
SCHEMBL6242093 0.87 CYP11B1 (0.35) ALDH1A1CYP1A2CYP2D6CYP2C19LMNA
SCHEMBL6242553 0.85 ALDH1A1 (0.41) ALDH1A1HTTMEN1KMT2ACYP1A2
SCHEMBL6241141 0.82 CYP11B1 (0.35) ALDH1A1CYP1A2CYP2D6CYP2C19LMNA
SCHEMBL6239997 0.80 CYP11B1 (0.36) ALDH1A1CYP1A2CYP2D6CYP2C19LMNA
SCHEMBL6240738 0.78 ADAM17 (0.37) GSK3BCYP11B1CYP11B2
SCHEMBL6242487 0.78 ALDH1A1 (0.46) ALDH1A1HTTMEN1KMT2ALMNA
SCHEMBL6246324 0.78 PSEN1 (0.43) ALDH1A1MEN1KMT2ALMNASLC6A9

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
EP-1395550-B1 CYCLOALKENYLSULFONAMIDE DERIVATIVES LILLY CO ELI (US) 2005-06-29 EP disclosed
US-20040157817-A1 Cycloalkenylsulfonamide derivatives CANTELL BUDDY EUGENE (US) 2004-08-12 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-20040157817-A1 Cycloalkenylsulfonamide derivatives GRIN2B, GRIN2A, GRIN1 ALDH1A1 1083/4885HTT 628/4885MEN1 3961/4885

“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.