SCHEMBL8950397

SCHEMBL8950397

NS(=O)(=O)c1cc2c(s1)S(=O)(=O)N(c1cccc(O)c1)C(CN1CCOCC1)=C2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA2 P00918 17/20 1.00
CA4 P22748 2/20 1.00
PIK3CD O00329 1/20 0.32
PIK3CA P42336 1/20 0.32
PIK3CB P42338 1/20 0.32
PIK3CG P48736 1/20 0.32
CTSB P07858 1/20 0.31

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
Hydrochloric Acid SCHEMBL8950360 0.87 CA2 (0.98) CA2CA4
SCHEMBL8950278 0.86 CA2 (0.75) CA2CA4PIK3CA
Hydrochloric Acid SCHEMBL8950327 0.85 CA2 (0.74) CA2CA4PIK3CA
Hydrochloric Acid SCHEMBL8950342 0.82 CA2 (0.84) CA2CA4
SCHEMBL9058131 0.80 CA2 (0.67) CA2CA4PIK3CDPIK3CAPIK3CB
SCHEMBL8950571 0.79 CA2 (0.65) CA2CA4
SCHEMBL8950256 0.78 CA2 (0.64) CA2CA4CTSB
Hydrochloric Acid SCHEMBL8950440 0.78 CA2 (0.64) CA2CA4
SCHEMBL8950259 0.77 CA2 (0.63) CA2CA4
Hydrochloric Acid SCHEMBL8950237 0.77 CA2 (0.62) CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5538966-A ENZYME INHIBITORS FOR TREATMENT OF GLAUCOMA ALCON LABORATORIES, INC. (US) 1996-07-23 US claimed
EP-3681504-B1 METHODS OF DETECTION USING X-RAY FLUORESCENCE ICAGEN INC (US) 2023-08-23 EP disclosed
US-11573224-B2 Methods of detection using X-ray fluorescence ICAGEN, LLC (US) 2023-02-07 US disclosed
US-11446398-B2 Regulated biocircuit systems OBSIDIAN THERAPEUTICS, INC. (US) 2022-09-20 US disclosed
US-5538966-A ENZYME INHIBITORS FOR TREATMENT OF GLAUCOMA ALCON LABORATORIES, INC. (US) 1996-07-23 US disclosed