SCHEMBL5886085

SCHEMBL5886085

Cc1ccc(S(=O)(=O)N2CCC[C@H]2CCCCl)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 2/20 0.56
PSEN2 P49810 2/20 0.56
APH1B Q8WW43 2/20 0.56
NCSTN Q92542 2/20 0.56
APH1A Q96BI3 2/20 0.56
PSENEN Q9NZ42 2/20 0.56
HTR7 P34969 5/20 0.55
RAB9A P51151 2/20 0.49
CASP3 P42574 2/20 0.49
CASP7 P55210 2/20 0.49
CASP1 P29466 1/20 0.49
HTR1A P08908 2/20 0.48
DRD2 P14416 2/20 0.48
HTR1D P28221 2/20 0.48
HTR1B P28222 2/20 0.48
DRD3 P35462 2/20 0.48
HTR1E P28566 1/20 0.48
ADRA1B P35368 1/20 0.48
PAX8 Q06710 1/20 0.47
TP53 P04637 1/20 0.47

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
SCHEMBL5886080 1.00 PSEN1 (0.56) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5885825 0.87 HTR7 (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5886009 0.87 HTR7 (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5885831 0.87 HTR7 (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL19011491 0.84 PSEN1 (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL21132496 0.84 PSEN1 (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL17661792 0.82 PSEN1 (0.52) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL19000604 0.82 PSEN1 (0.70) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL12169293 0.82 PSEN1 (0.70) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5885854 0.81 FKBP1A (0.56) PSEN1PSEN2APH1BNCSTNAPH1A

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-6995182-B2 1-sulfonyl pyrrolidine derivatives HOFFMANN-LA ROCHE INC. (US) 2006-02-07 US disclosed
US-20030212066-A1 1-Sulfonyl pyrrolidine derivatives MUTEL VINCENT (FR) 2003-11-13 US disclosed
US-6589978-B2 Therapy for nervous system disorders HOFFMAN-LA ROCHE INC. 2003-07-08 US disclosed
EP-1299383-A1 SULFONYL-PYRROLIDINE DERIVATIVES USEFUL FOR THE TREATMENT OF NEUROLOGICAL DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 2003-04-09 EP disclosed
US-20020019424-A1 1-sulfonyl pyrrolidine derivatives F. HOFFMANN-LA ROCHE AG (CH) 2002-02-14 US disclosed
WO-2002002554-A1 SULFONYL-PYRROLIDINE DERIVATIVES USEFUL FOR THE TREATMENT OF NEUROLOGICAL DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 2002-01-10 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 (2 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-20030212066-A1 1-Sulfonyl pyrrolidine derivatives GRM1, GRM2, GRIN1 PSEN1 334/4885PSEN2 561/4885APH1B 1318/4885
US-20020019424-A1 1-sulfonyl pyrrolidine derivatives GRM1, GRM2, GRIN1 PSEN1 334/4885PSEN2 561/4885APH1B 1318/4885

“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.