SCHEMBL6705268

SCHEMBL6705268

O=S(=O)(NC1CCC1)NC1C2CCC1Cc1cc(OCc3ccccc3)ccc1C2

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 12/20 0.49
PSEN2 P49810 12/20 0.49
APH1B Q8WW43 12/20 0.49
NCSTN Q92542 12/20 0.49
APH1A Q96BI3 12/20 0.49
PSENEN Q9NZ42 12/20 0.49
HRH3 Q9Y5N1 5/20 0.47
CYP2D6 P10635 3/20 0.47
MAOA P21397 2/20 0.42
MAOB P27338 2/20 0.42
HRH1 P35367 1/20 0.42

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
SCHEMBL6701989 0.76 KDM1A (0.53) HRH3CYP2D6MAOAMAOBHRH1
Hydrochloric Acid SCHEMBL6697715 0.75 PSEN1 (0.66) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5074380 0.74 PSEN1 (0.64) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5071689 0.73 PSEN1 (0.66) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL4045668 0.71 MAOA (0.52) HRH3CYP2D6MAOAMAOBHRH1
SCHEMBL14263757 0.71 MAOA (0.52) HRH3CYP2D6MAOAMAOBHRH1
SCHEMBL5143709 0.70 GRIN2B (0.54) HRH3CYP2D6MAOAMAOBHRH1
SCHEMBL12471199 0.70 HRH3 (0.51) HRH3CYP2D6MAOAMAOBHRH1
SCHEMBL5074366 0.69 PSEN1 (0.73) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL12472053 0.69 FAAH (0.59) HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040049038-A1 Sulfamides as gamma-secretase inhibitors MERCK SHARP & DOHME (UK) LIMITED (GB) 2004-03-11 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-20040049038-A1 Sulfamides as gamma-secretase inhibitors BACE1, BACE2, PSEN1 PSEN1 3/4885PSEN2 5/4885APH1B 8/4885

“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.