SCHEMBL2869664

SCHEMBL2869664

C=CC(=O)NC(C)(C)CS(=O)O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TSHR P16473 2/20 0.35
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ZDHHC20 Q5W0Z9 1/20 0.35
ZDHHC2 Q9UIJ5 1/20 0.35
GAA P10253 1/20 0.32

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
SCHEMBL23741142 0.80 ALDH1A1 (0.44) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL19860763 0.77 ALDH1A1 (0.55) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL17036952 0.77 ALDH1A1 (0.44) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL460924 0.75 ALDH1A1 (0.53) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL7612005 0.75 ALDH1A1 (0.53) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
Sulfurous Acid SCHEMBL8975620 0.75 ALDH1A1 (0.41) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL903004 0.75 ALDH1A1 (0.53) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL36167 0.74 ALDH1A1 (0.51) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL9252889 0.74 ALDH1A1 (0.51) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1
SCHEMBL35505 0.74 ALDH1A1 (0.51) ALDH1A1CYP3A4CYP2C9CYP2C19MEN1

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 62 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8449868-B2 Preparation of cationic nanoparticles and personal care compositions comprising said nanoparticles BASF SE (DE) 2013-05-28 US claimed
CN-102112100-A Preparation of cationic nanoparticles and personal care compositions containing the same BASF SE 2011-06-29 CN claimed
EP-2254545-A2 PREPARATION OF CATIONIC NANOPARTICLES AND PERSONAL CARE COMPOSITIONS COMPRISING SAID NANOPARTICLES BASF SE (DE) 2010-12-01 EP claimed
US-20090214447-A1 Preparation of cationic nanoparticles and personal care compositions comprising said nanoparticles BASF SE (DE) 2009-08-27 US claimed
WO-2009103651-A2 PREPARATION OF CATIONIC NANOPARTICLES AND PERSONAL CARE COMPOSITIONS COMPRISING SAID NANOPARTICLES BASF SE (DE) 2009-08-27 WO claimed
EP-1059305-B1 Inverse emulsion polymer and production thereof CALGON CORP (US) 2008-08-27 EP claimed
CN-1307267-C Water composite containing polymer nanoparticle ROHM & HAAS (US) 2007-03-28 CN claimed
EP-4321489-B1 CATIONIC POLYACRYLAMIDES WITH MICRO-BLOCK STRUCTURE SNF GROUP (FR) 2025-03-05 EP disclosed
EP-3592803-B1 A POLYMER COATED SULPHUR CURED RUBBER COMPOSITION SUBLINO LTD (GB) 2021-12-22 EP disclosed
EP-3458425-B1 GYPSUM SLURRIES WITH LINEAR POLYCARBOXYLATE DISPERSANTS UNITED STATES GYPSUM CO (US) 2020-07-08 EP disclosed
US-10662149-B2 Method for producing the 2-acrylamido-2-methylpropane sulfonic acid monomer and polymer comprising said monomer S.P.C.M. SA (FR) 2020-05-26 US disclosed
EP-2860215-A1 MODIFIED HYDROPHILIC ACRYLIC RESIN FILM Mitsui Chemicals, Inc. (JP) 2015-04-15 EP disclosed
CN-102112100-B Preparation of cationic nanoparticles and personal care compositions comprising said nanoparticles BASF SE 2013-08-21 CN disclosed
EP-1371718-A1 Polymeric nanoparticle formulations and their use as fabric care additives ROHM AND HAAS COMPANY (US) 2003-12-17 EP disclosed
EP-1371705-A1 Water-based adhesives ROHM AND HAAS COMPANY (US) 2003-12-17 EP disclosed
US-20030068440-A1 Process for producing extraction-resistant polymer coatings CREAVIS GESELLSCHAFT FUER TECH. UND INNOVATION MBH (DE) 2003-04-10 US disclosed
EP-0745894-B1 Black and white photographic elements containing release compounds and method of preparing photographic emulsion EASTMAN KODAK CO (US) 2003-01-22 EP disclosed
EP-0745894-A1 Black and white photographic elements containing release compounds and method of preparing photographic emulsion EASTMAN KODAK COMPANY (US) 1996-12-04 EP disclosed
US-5523367-A DISPOSABLE PRODUCTS PHILLIPS PETROLEUM COMPANY (US) 1996-06-04 US disclosed
US-5500338-A Black and white photographic elements containing release compounds and method of preparing photographic emulsion EASTMAN KODAK COMPANY (US) 1996-03-19 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 (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-10662149-B2 Method for producing the 2-acrylamido-2-methylpropane sulfonic acid monomer and polymer comprising said monomer MTHFD2, MPST, BHMT2 ALDH1A1 266/4885CYP3A4 1545/4885CYP2C9 1057/4885
US-20090214447-A1 Preparation of cationic nanoparticles and personal care compositions comprising said nanoparticles CUTA, ARG1, ARG2 ALDH1A1 3471/4885CYP3A4 4848/4885CYP2C9 2549/4885

“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.