SCHEMBL154162

SCHEMBL154162

C=C(C)C(=O)N(CCC)CCC

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.46
CA9 Q16790 5/20 0.46
CA2 P00918 3/20 0.46
TSHR P16473 3/20 0.43
MAPK1 P28482 1/20 0.43
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
TP53 P04637 1/20 0.39
CA1 P00915 4/20 0.39
TDP1 Q9NUW8 2/20 0.33
POLB P06746 1/20 0.33
APEX1 P27695 1/20 0.33
MLYCD O95822 1/20 0.32
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP3 P08254 1/20 0.31
MMP8 P22894 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
SCHEMBL376061 0.91 CA12 (0.47) CA12CA9CA2TSHRMAPK1
SCHEMBL8999574 0.91 CA12 (0.40) CA12CA9CA2TSHRMAPK1
SCHEMBL11667506 0.91 TDP1 (0.50) CA12CA9CA2TSHRMAPK1
SCHEMBL375752 0.91 CA12 (0.43) CA12CA9CA2TSHRMAPK1
SCHEMBL375966 0.89 CA12 (0.41) CA12CA9CA2TSHRMAPK1
SCHEMBL1066848 0.89 CA12 (0.41) CA12CA9CA2TSHRMAPK1
SCHEMBL430880 0.88 TSHR (0.43) CA12CA9CA2TSHRCA1
SCHEMBL12200648 0.88 TSHR (0.43) CA12CA9CA2TSHRCA1
SCHEMBL375826 0.88 TSHR (0.43) CA12CA9CA2TSHRCA1
SCHEMBL375774 0.88 TSHR (0.43) CA12CA9CA2TSHRCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3231411-B1 AQUEOUS DENTAL GLASS IONOMER COMPOSITION DENTSPLY DETREY GMBH (DE) 2021-11-10 EP claimed
US-10624821-B2 Aqueous dental glass ionomer composition DENTSPLY SIRONA INC. (US) 2020-04-21 US claimed
US-10610462-B2 Aqueous dental glass ionomer composition DENTSPLY SIRONA INC. (US) 2020-04-07 US claimed
EP-1984121-B1 NON-LEACHING SURFACE-ACTIVE FILM COMPOSITIONS FOR MICROBIAL ADHESION PREVENTION HYDROMER INC (US) 2019-05-08 EP claimed
US-10272017-B2 Aqueous dental glass ionomer composition DENTSPLY SIRONA INC. (US) 2019-04-30 US claimed
US-20170296441-A1 AQUEOUS DENTAL GLASS IONOMER COMPOSITION DENTSPLY SIRONA INC. (US) 2017-10-19 US claimed
US-20170296442-A1 AQUEOUS DENTAL GLASS IONOMER COMPOSITION DENTSPLY SIRONA INC. (US) 2017-10-19 US claimed
EP-3231411-A2 AQUEOUS DENTAL GLASS IONOMER COMPOSITION DENTSPLY DETREY GmbH (DE) 2017-10-18 EP claimed
EP-3231412-A2 AQUEOUS DENTAL GLASS IONOMER COMPOSITION DENTSPLY DETREY GmbH (DE) 2017-10-18 EP claimed
US-20150159009-A1 GRAFT COPOLYMERS, THEIR PREPARATION AND USE IN CAPILLARY ELECTROPHORESIS APPLIED BIOSYSTEMS LLC (US) 2015-06-11 US claimed
US-20070099816-A1 Hard Surface Cleaning Composition THE CLOROX COMPANY 2007-05-03 US claimed
US-20060074142-A1 Aqueous inks containing colored polymers XEROX CORPORATION 2006-04-06 US claimed
US-20050234166-A1 Graft copolymers, their preparation and use in capillary electrophoresis APPLIED BIOSYSTEMS, INC. 2005-10-20 US claimed
EP-1539846-A1 GRAFT COPOLYMERS, THEIR PREPARATION AND USE IN CAPILLARY ELECTROPHORESIS Applera Corporation (US) 2005-06-15 EP claimed
EP-0847050-B1 Optical recording medium MITSUBISHI CHEM CORP (JP) 2004-11-17 EP claimed
WO-2004011513-A1 GRAFT COPOLYMERS, THEIR PREPARATION AND USE IN CAPILLARY ELECTROPHORESIS APPLERA CORPORATION (US) 2004-02-05 WO claimed
US-5972457-A COMPRISING TRANSPARENT SUBSTRATE, RECORDING LAYER, REFLECTIVE LAYER, PROTECTIVE LAYER, AND INK-RECEIVING LAYER CONTAINING HYDROPHILIC AND WATER INSOLUBLE FILLER MITSUBISHI CHEMICAL CORPORATION (JP) 1999-10-26 US claimed
EP-0120708-B1 POLYOLEFIN SUBSTRATE COATED WITH ACRYLIC-TYPE NORMALLY TACKY AND PRESSURE-SENSITIVE ADHESIVE MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1987-11-19 EP claimed
US-4563388-A PRIMER LAYER OF ACRYLIC MONOMER GRAFT POLYMERIZED TO SURFACE MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1986-01-07 US claimed
EP-0120708-A1 Polyolefin substrate coated with acrylic-type normally tacky and pressure-sensitive adhesive MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1984-10-03 EP 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 (5 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-20170296441-A1 AQUEOUS DENTAL GLASS IONOMER COMPOSITION GLUL, GDA, PHAX CA12 1003/4885CA9 1153/4885CA2 447/4885
US-20170296442-A1 AQUEOUS DENTAL GLASS IONOMER COMPOSITION COG1, GDA, COG2 CA12 512/4885CA9 303/4885CA2 75/4885
US-10624821-B2 Aqueous dental glass ionomer composition GDA, COG1, COG2 CA12 283/4885CA9 253/4885CA2 69/4885
US-10610462-B2 Aqueous dental glass ionomer composition GLUL, GDA, PHAX CA12 988/4885CA9 966/4885CA2 522/4885
US-10272017-B2 Aqueous dental glass ionomer composition COG1, GDA, COG2 CA12 512/4885CA9 303/4885CA2 75/4885

“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.