SCHEMBL45240

SCHEMBL45240

C=CCNC(=O)C(=C)CO

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MAPT P10636 1/20 0.45
KMT2A Q03164 1/20 0.42
ALDH1A1 P00352 5/20 0.38
FAAH O00519 1/20 0.37
RAB9A P51151 2/20 0.37
KDM4E B2RXH2 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HPGD P15428 3/20 0.35
LMNA P02545 2/20 0.34
CYP1A2 P05177 1/20 0.34

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
SCHEMBL1077999 0.82 TSHR (0.45) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL30961 0.80 TSHR (0.43) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL7170680 0.80 TSHR (0.43) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL30285352 0.80 TSHR (0.43) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL9047033 0.80 ALOX15 (0.48) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL4952777 0.80 TSHR (0.56) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL8003440 0.78 ALDH1A1 (0.45) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL5140971 0.78 TSHR (0.42) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL30285305 0.77 TSHR (0.41) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL4565106 0.77 TSHR (0.41) TSHRSMN1; SMN2MAPTKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114630818-A Protein-macromolecule conjugates and methods of use thereof 北京轩义医药科技有限公司 2022-06-14 CN claimed
EP-3105367-B1 PRIMARY AMINE-CONTAINING POLYMERS USEFUL AS SCALE INHIBITORS CYTEC IND INC (US) 2020-11-04 EP claimed
WO-2020162629-A1 PATCH 株式会社メディカルフロント 2020-08-13 WO claimed
US-10646505-B2 DNA-functionalized scaffolds for drug capture applications CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2020-05-12 US claimed
EP-2496987-B1 A SILICONE HYDROGEL LENS WITH A GRAFTED HYDROPHILIC COATING ALCON INC (CH) 2020-04-29 EP claimed
EP-2625216-B1 POLYMERISABLE CHAIN-EXTENDED POLYSILOXANES WITH PENDANT HYDROPHILIC GROUPS NOVARTIS AG (CH) 2019-06-05 EP claimed
CN-109310981-A Composite material, its preparation and gas purification purposes 南洋理工大学 2019-02-05 CN claimed
EP-3068814-B1 AQUEOUS DISPERSION OF POLYMER MADE FROM MULTISTRUCTURED PARTICLES FOR AQUEOUS COATINGS HAVING IMPROVED BLOCKING AND FINGERPRINT RESISTANCE AND HARDNESS ARKEMA FRANCE (FR) 2018-08-08 EP claimed
US-10035923-B2 Aqueous dispersion of polymer made from multistructured particles for aqueous coatings having improved blocking and fingerprint resistance and hardness ARKEMA FRANCE (FR) 2018-07-31 US claimed
EP-2625217-B1 CHAIN-EXTENDED POLYSILOXANE CROSSLINKERS WITH DANGLING HYDROPHILIC POLYMER CHAINS NOVARTIS AG (CH) 2018-07-04 EP claimed
EP-0661320-A1 Aqueous coating and its use in coating substrates Herberts Gesellschaft mit beschränkter Haftung (DE) 1995-07-05 EP claimed
EP-0465302-B1 Precursors of isocyanurate polymers having hydroxyl, urethane, isocyanate or acrylate groups, and process for their preparation ATOCHEM ELF SA (FR) 1994-12-28 EP claimed
EP-0430769-B1 Application of antiadherent polyester composite films as supports for the fabrication of at least one layer of polyurethane utilisable in safety glasses SAINT GOBAIN VITRAGE (FR) 1994-07-13 EP claimed
EP-0419615-B1 COMPOSITE POLYESTER FILMS AS FINAL COATING SUPPORTS RHONE-POULENC FILMS (FR) 1993-09-29 EP claimed
US-5141783-A Using a support film of semicrystalline polyester having coatings of fluoropolymer and a sulfo-containing polyester SAINT-GOBAIN VITRAGE INTERNATIONAL C/O SAINT-GOBAIN RECHERCHE (FR) 1992-08-25 US claimed
US-5128206-A Magnetic recording supports RHONE-POULENC CHIMIE (FR) 1992-07-07 US claimed
EP-0465302-A1 Precursors of isocyanurate polymers having hydroxyl, urethane, isocyanate or acrylate groups, and process for their preparation ELF ATOCHEM S.A. (FR) 1992-01-08 EP claimed
EP-0378954-A2 Composite polyester films useful as magnetic recording carriers, and magnetic recording materials RHONE-POULENC FILMS (FR) 1990-07-25 EP claimed
US-4101461-A Method for preparation of anion exchangers by substitution of hydrophilic polymeric gels CZECHOSLOVENSKA AKADEMIE VED (CS) 1978-07-18 US claimed
US-3991018-A Method for preparation of cation exchangers by substitution of hydrophilic polymeric gels of crosslinked hydroxyalkyl acrylates and hydroxyalkylacrylamides CESKOSLOVENSKA AKADEMIE VED (CS) 1976-11-09 US claimed

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-10646505-B2 DNA-functionalized scaffolds for drug capture applications TOP1, TOP2A, DNA2 TSHR 3282/4885SMN1; SMN2 1336/4885MAPT 1309/4885

“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.