SCHEMBL3757147

SCHEMBL3757147

COc1ccc(S(=O)(=O)N2CC(C(=O)O)c3ccccc32)cc1OC

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.55
PDE4B Q07343 1/20 0.55
PDE4C Q08493 1/20 0.55
PDE4D Q08499 1/20 0.55
HTR6 P50406 14/20 0.51
USP2 O75604 1/20 0.49
LMNA P02545 1/20 0.49
GLA P06280 1/20 0.49
TSHR P16473 1/20 0.49
MAPK1 P28482 1/20 0.49
HSD17B10 Q99714 1/20 0.49
KCNH2 Q12809 1/20 0.46

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
SCHEMBL3750919 0.81 HTR6 (0.67) HTR6KCNH2
SCHEMBL3744515 0.81 HTR6 (0.74) HTR6TSHRKCNH2
SCHEMBL13043255 0.81 HTR6 (0.55) HTR6LMNA
SCHEMBL3754257 0.79 HTR6 (0.68) HTR6KCNH2
Trifluoroacetic Acid SCHEMBL3752085 0.78 HTR6 (0.71) PDE4APDE4BPDE4CPDE4DHTR6
SCHEMBL4180004 0.76 PDE4A (0.78) PDE4APDE4BPDE4CPDE4DUSP2
SCHEMBL13947280 0.72 HTR6 (0.58) PDE4APDE4BPDE4CPDE4DHTR6
SCHEMBL14399667 0.71 HTR6 (0.52) HTR6USP2LMNA
SCHEMBL7356297 0.71 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7421596 0.70 PDE4A (0.60) PDE4APDE4BPDE4CPDE4DLMNA

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
US-7838518-B2 1-arylsulfonyl-3-substituted indole and indoline derivatives useful in the treatment of central nervous system disorders N.V. ORGANON (NL) 2010-11-23 US disclosed
EP-1476151-B1 1-ARYLSULFONYL-3-SUBSTITUED INDOLE AND INDOLINE DERIVATES USEFUL IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS ORGANON NV (NL) 2008-07-16 EP disclosed
US-20050154023-A1 1-arylsulfonyl-3-substituted indole and indoline derivatives useful in the treatment of central nervous system disorders MERCK SHARP & DOHME B.V. (NL) 2005-07-14 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-20050154023-A1 1-arylsulfonyl-3-substituted indole and indoline derivatives useful in the treatment of central nervous system disorders TPH1, HTR1A, HTR1D PDE4A 4155/4885PDE4B 4294/4885PDE4C 4220/4885

“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.