SCHEMBL2220869

SCHEMBL2220869

O=S(=O)(c1ccc(F)cc1)N1C2CCCC1CCC2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.51
ACHE P22303 5/20 0.50
KDM4E B2RXH2 2/20 0.50
MMP2 P08253 1/20 0.50
GAA P10253 2/20 0.49
PSEN1 P49768 1/20 0.49
PSEN2 P49810 1/20 0.49
APH1B Q8WW43 1/20 0.49
NCSTN Q92542 1/20 0.49
APH1A Q96BI3 1/20 0.49
PSENEN Q9NZ42 1/20 0.49
PKM P14618 1/20 0.49
KDM2B Q8NHM5 1/20 0.48
MAPT P10636 2/20 0.48
CYP3A4 P08684 2/20 0.48
CYP2C19 P33261 2/20 0.48
AKR1C3 P42330 1/20 0.46
USP2 O75604 1/20 0.45
ALDH1A1 P00352 1/20 0.45

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
SCHEMBL2221432 0.81 PSEN1 (0.72) L3MBTL1ACHEMMP2PSEN1PSEN2
SCHEMBL2221744 0.81 ACHE (0.50) L3MBTL1ACHEMMP2PSEN1PSEN2
SCHEMBL2219745 0.80 ACHE (0.54) ACHEGAAPSEN1PSEN2APH1B
SCHEMBL19640858 0.80 AKR1C3 (0.49) TRPA1L3MBTL1KDM4EMMP2GAA
SCHEMBL3699840 0.79 ACHE (0.49) L3MBTL1ACHEMMP2PSEN1PSEN2
SCHEMBL21441975 0.79 ACHE (0.62) TRPA1ACHEMMP2PSEN1PSEN2
SCHEMBL21442061 0.79 ACHE (0.62) TRPA1ACHEMMP2PSEN1PSEN2
SCHEMBL2221418 0.79 ACHE (0.49) L3MBTL1ACHEMMP2PSEN1PSEN2
SCHEMBL2220964 0.79 PSEN1 (0.70) L3MBTL1ACHEMMP2PSEN1PSEN2
SCHEMBL19013821 0.79 AKR1C3 (0.51) TRPA1KDM4EMMP2PKMMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110178119-A1 Bridged N-Bicyclic Sulfonamido Inhibitors of Gamma Secretase ELAN PHARMACEUTICALS, INC. (US) 2011-07-21 US claimed
EP-1915371-A2 BRIDGED N-BICYCLIC SULFONAMIDO INHIBITORS OF GAMMA SECRETASE Elan Pharmaceuticals Inc. (US) 2008-04-30 EP claimed
WO-2007024651-A2 BRIDGED N-BICYCLIC SULFONAMIDO INHIBITORS OF GAMMA SECRETASE ELAN PHARMACEUTICALS, INC. (US) 2007-03-01 WO claimed
US-20110178119-A1 Bridged N-Bicyclic Sulfonamido Inhibitors of Gamma Secretase ELAN PHARMACEUTICALS, INC. (US) 2011-07-21 US disclosed
EP-1915371-A2 BRIDGED N-BICYCLIC SULFONAMIDO INHIBITORS OF GAMMA SECRETASE Elan Pharmaceuticals Inc. (US) 2008-04-30 EP disclosed
WO-2007024651-A2 BRIDGED N-BICYCLIC SULFONAMIDO INHIBITORS OF GAMMA SECRETASE ELAN PHARMACEUTICALS, INC. (US) 2007-03-01 WO 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-20110178119-A1 Bridged N-Bicyclic Sulfonamido Inhibitors of Gamma Secretase BACE1, BACE2, PSEN1 TRPA1 4453/4885L3MBTL1 4120/4885ACHE 17/4885

“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.