SCHEMBL2158113

SCHEMBL2158113

C=CC(=O)NC(C)N(CC)CC

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.54
ALDH1A1 P00352 3/20 0.37
MAPK1 P28482 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
ACACB O00763 2/20 0.36
ZDHHC20 Q5W0Z9 1/20 0.36
ZDHHC2 Q9UIJ5 1/20 0.36
CYP2C19 P33261 1/20 0.33
GAA P10253 1/20 0.32
PGR P06401 1/20 0.31
ADRA2A P08913 1/20 0.31
ADRA2B P18089 1/20 0.31
HTR2A P28223 1/20 0.31
HRH1 P35367 1/20 0.31
KCNH2 Q12809 1/20 0.31
FDPS P14324 1/20 0.30

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 SCHEMBL11063367 0.98 TSHR (0.52) TSHRALDH1A1MAPK1TDP1ACACB
SCHEMBL8012768 0.93 TSHR (0.47) TSHRALDH1A1MAPK1TDP1ACACB
SCHEMBL10349334 0.85 TSHR (0.50) TSHRALDH1A1MAPK1TDP1ACACB
SCHEMBL7633568 0.83 TSHR (0.39) TSHR
SCHEMBL9067313 0.83 TSHR (0.39) TSHR
SCHEMBL8040760 0.83 TSHR (0.39) TSHR
SCHEMBL11909204 0.82 TSHR (0.47) TSHRALDH1A1MAPK1TDP1ACACB
SCHEMBL8040743 0.80 TSHR (0.36) TSHR
SCHEMBL9314184 0.78 TSHR (0.47) TSHRALDH1A1MAPK1TDP1ACACB
SCHEMBL3285064 0.78 TSHR (0.47) TSHRALDH1A1MAPK1TDP1ACACB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1148944-B1 SURFACE MODIFIED DIVINYLBENZENE RESIN HAVING A HEMOCOMPATIBLE COATING DOW GLOBAL TECHNOLOGIES INC (US) 2010-04-21 EP claimed
US-20060181587-A1 Ink set and media for ink-jet printing HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2006-08-17 US claimed
EP-0710680-B1 Aqueous polymer dispersion BASF AG (DE) 2003-03-19 EP claimed
US-4857621-A Cationic polymeric stabilizers for oil-in-water emulsions THE STANDARD OIL COMPANY (US) 1989-08-15 US claimed
EP-0040124-B1 HYDROPHILIC COPOLYMERS BASED ON N-TRIS(HYDROXY-METHYL)METHYLACRYL AMIDE, PROCESS FOR THEIR PREPARATION, AQUEOUS GEL OF THESE COPOLYMERS AND THEIR USE AS ION EXCHANGERS PHARMUKA LABORATOIRES (FR) 1985-03-27 EP claimed
EP-0040124-A1 Hydrophilic copolymers based on N-tris(hydroxy-methyl)methylacryl amide, process for their preparation, aqueous gel of these copolymers and their use as ion exchangers PHARMUKA LABORATOIRES (FR) 1981-11-18 EP claimed
US-20250382506-A1 SHELF STABLE ADHESIVE COMPOSITIONS UNIV KANSAS (US) 2025-12-18 US disclosed
US-20250340760-A1 ADHESIVE COMPOSITIONS CONTAINING MAGNETIC PARTICLES UNIV KANSAS (US) 2025-11-06 US disclosed
US-12351745-B2 Single-component adhesive compositions OHIO STATE INNOVATION FOUNDATION (US) 2025-07-08 US disclosed
WO-2025096421-A1 AQUEOUS FLUOROPOLYMER BASED DISPERSIONS INCLUDING SILICONE GROUPS ARKEMA INC. (US) 2025-05-08 WO disclosed
WO-2025049240-A2 BIO-BASED ELASTOMERIC POLYMER COMPOSITIONS ARKEMA INC. (US) 2025-03-06 WO disclosed
CN-115873511-A Solvent-free UV viscosity-reducing composition and preparation method and application thereof 广州鹿山新材料股份有限公司 2023-03-31 CN disclosed
EP-4136173-A1 FAST HARDENING AQUEOUS COATING COMPOSITIONS CONTAINING GRAFT COPOLYMER OF POLYAMINE AND VINYL MONOMERS Arkema, Inc. (US) 2023-02-22 EP disclosed
US-4895900-A ACRYLIC RESIN, PHOSPHOROUS ACID, EPOXY COMPOUND KANSAI PAINT COMPANY, LIMITED (JP) 1990-01-23 US disclosed
EP-0040124-B1 HYDROPHILIC COPOLYMERS BASED ON N-TRIS(HYDROXY-METHYL)METHYLACRYL AMIDE, PROCESS FOR THEIR PREPARATION, AQUEOUS GEL OF THESE COPOLYMERS AND THEIR USE AS ION EXCHANGERS PHARMUKA LABORATOIRES (FR) 1985-03-27 EP disclosed
US-4452916-A Hydrophilic copolymers based on N-[tris(hydroxymethyl)methyl]-acrylamide, processes for their preparation, aqueous gels of said copolymers and their use as ion exchangers PHARMINDUSTRIE (FR) 1984-06-05 US disclosed
WO-1983002115-A1 CATIONIC ACRYLAMIDE AND RUBBER MODIFIED ASPHALTS OWENS CORNING FIBERGLASS CORP (US) 1983-06-23 WO disclosed
US-4374924-A CATIONIC POLYMERS COMPRISING QUATERNIZED COPOLYMERS OF P-DIVINYLBENZENE OR A DIACRYLIC ESTER AND AN AMINO-CONTAINING ACRYLIC ESTER OR AMIDE FUJI PHOTO FILM CO., LTD. (JP) 1983-02-22 US disclosed
EP-0040124-A1 Hydrophilic copolymers based on N-tris(hydroxy-methyl)methylacryl amide, process for their preparation, aqueous gel of these copolymers and their use as ion exchangers PHARMUKA LABORATOIRES (FR) 1981-11-18 EP disclosed
US-4012437-A Method of producing betaines, monomers and polymers containing betaine-type units and novel and useful copolymers thereby obtained ROHM AND HAAS COMPANY (US) 1977-03-15 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-20250340760-A1 ADHESIVE COMPOSITIONS CONTAINING MAGNETIC PARTICLES FN1, EPCAM, VCL TSHR 4451/4885ALDH1A1 1615/4885MAPK1 1718/4885

“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.