SCHEMBL5254341

SCHEMBL5254341

O=S(=O)(c1ccc(Cl)cc1)N1CCCC(CO)C1

nearest known ligand 0.76

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.76
CYP2C19 P33261 1/20 0.76
POLB P06746 2/20 0.60
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
USP2 O75604 1/20 0.53
LMNA P02545 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
GAA P10253 1/20 0.51
ALDH1A1 P00352 2/20 0.50
MAPK1 P28482 1/20 0.50
MAPT P10636 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.49
AKR1C3 P42330 1/20 0.49
AKR1C1 Q04828 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
CNR1 P21554 1/20 0.49
DPP4 P27487 1/20 0.48

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
SCHEMBL12587132 0.86 CYP3A4 (0.76) CYP3A4CYP2C19POLBMEN1KMT2A
SCHEMBL19265264 0.86 CYP3A4 (0.76) CYP3A4CYP2C19POLBMEN1KMT2A
SCHEMBL4741603 0.86 CYP2C19 (0.75) CYP3A4CYP2C19LMNAL3MBTL1ALDH1A1
SCHEMBL14132786 0.85 CYP3A4 (0.70) CYP3A4CYP2C19POLBMEN1KMT2A
SCHEMBL5252305 0.84 LMNA (0.67) CYP3A4MEN1KMT2ALMNAL3MBTL1
SCHEMBL12189229 0.84 CYP2C19 (0.72) CYP3A4CYP2C19MEN1KMT2ALMNA
SCHEMBL11535912 0.83 CYP3A4 (0.70) CYP3A4CYP2C19POLBUSP2LMNA
SCHEMBL12169360 0.83 CYP3A4 (0.70) CYP3A4CYP2C19POLBMEN1KMT2A
SCHEMBL5252269 0.81 POLB (0.64) POLBMEN1KMT2AUSP2LMNA
SCHEMBL8060895 0.81 POLB (0.54) CYP3A4CYP2C19POLBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1758884-A2 N-CYCLIC SULFONAMIDO INHIBITORS OF GAMMA SECRETASE Elan Pharmaceuticals, Inc. (US) 2007-03-07 EP claimed
US-20060035884-A1 N-cyclic sulfonamido inhibitors of gamma secretase ELAN PHARMACEUTICALS, INC. (US) 2006-02-16 US claimed
WO-2005113542-A2 N-CYCLIC SULFONAMIDO INHIBITORS OF GAMMA SECRETASE ELAN PHARMACEUTICALS, INC. (US) 2005-12-01 WO claimed

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-20060035884-A1 N-cyclic sulfonamido inhibitors of gamma secretase BACE1, BACE2, APH1B CYP3A4 2500/4885CYP2C19 1580/4885POLB 3326/4885

“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.