SCHEMBL33312

SCHEMBL33312

[CH2]CCCCCCCCCOC(=O)C(=C)C

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.71
POLB P06746 1/20 0.53
APEX1 P27695 1/20 0.53
HTT P42858 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
THRB P10828 1/20 0.52
ALDH1A1 P00352 4/20 0.40
CYP3A4 P08684 1/20 0.39
NAAA Q02083 1/20 0.36
RAD52 P43351 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
LMNA P02545 1/20 0.35
APOBEC3A P31941 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35
EPHX1 P07099 1/20 0.34
ACHE P22303 4/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33

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
SCHEMBL27459407 1.00 TSHR (0.71) TSHRPOLBAPEX1HTTTDP1
SCHEMBL9357929 1.00 TSHR (0.71) TSHRPOLBAPEX1HTTTDP1
SCHEMBL1228562 1.00 TSHR (0.71) TSHRPOLBAPEX1HTTTDP1
SCHEMBL227734 1.00 TSHR (0.71) TSHRPOLBAPEX1HTTTDP1
SCHEMBL329015 1.00 TSHR (0.71) TSHRPOLBAPEX1HTTTDP1
SCHEMBL10437170 1.00 TSHR (0.71) TSHRPOLBAPEX1HTTTDP1
SCHEMBL33382 1.00 TSHR (0.71) TSHRPOLBAPEX1HTTTDP1
SCHEMBL1142983 1.00 TSHR (0.71) TSHRPOLBAPEX1HTTTDP1
SCHEMBL1228461 1.00 TSHR (0.71) TSHRPOLBAPEX1HTTTDP1
SCHEMBL1228491 1.00 TSHR (0.71) TSHRPOLBAPEX1HTTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3415539-B1 POLYMERIZABLE COMPOSITION AND KIT THEREOF, AND POLYMERIZATION INITIATOR SUN MEDICAL CO LTD (JP) 2022-03-30 EP claimed
EP-2578201-B1 Dental materials with improved hydrolysis stability on the basis of phthalic acid monomers IVOCLAR VIVADENT AG (LI) 2020-11-25 EP claimed
EP-2716276-B1 Kit and method for indirect chair-side production of composite inlays VOCO GMBH (DE) 2019-04-24 EP claimed
EP-3013874-B1 ADDITIVE THAT IMPROVES ADHESION AND COATING COMPOUND CONTAINING THE SAME BYK CHEMIE GMBH (DE) 2016-12-14 EP claimed
EP-2047837-B1 Dental adhesive and use thereof KERR CORP (US) 2016-04-13 EP claimed
EP-1968528-B1 DENTAL COMPOSITIONS WITH SURFACE-TREATED FILLER FOR SHELF STABILITY 3M INNOVATIVE PROPERTIES CO (US) 2016-02-17 EP claimed
EP-1749513-B1 Photopolymerisable dental material with bisacylphosphine oxides as initiator IVOCLAR VIVADENT AG (LI) 2009-03-04 EP claimed
EP-1973587-A2 METHODS AND SYSTEMS FOR PREPARING ANTIMICROBIAL FILMS AND COATINGS Allaccem, Inc. (US) 2008-10-01 EP claimed
WO-2007070801-A2 METHODS AND SYSTEMS FOR PREPARING ANTIMICROBIAL FILMS AND COATINGS ALLACCEM, INC. (US) 2007-06-21 WO claimed
EP-1508321-B1 Dental adhesive composition DENTSPLY SANKIN K K (JP) 2007-05-23 EP claimed
US-6326417-B1 CONTAINING SALICYLIC ACID COMPOUND AS MICROBIOCIDES JENERIC/PENTRON INCORPORATED 2001-12-04 US claimed
US-20240208990-A1 SPIRO-COMPOUNDS AND COMPOSITIONS INCLUDING THE SAME SOLVENTUM INTELLECTUAL PROPERTIES COMPANY 2024-06-27 US disclosed
US-20240173211-A1 DENTAL RESIN-REINFORCED GLASS IONOMER CEMENT KIT SHOFU INC. (JP) 2024-05-30 US disclosed
EP-4347602-A1 SPIRO-COMPOUNDS AND COMPOSITIONS INCLUDING THE SAME Solventum Intellectual Properties Company (US) 2024-04-10 EP disclosed
EP-3604318-B1 PHOSPHORUS-CONTAINING COMPOUND MITSUI CHEMICALS INC (JP) 2024-01-17 EP disclosed
EP-0460496-B1 Tetra-amino-anthraquinone dyes BASF AG (DE) 1994-11-30 EP disclosed
CN-1023699-C Difluoromethyl compounds MERCK PATENT GMBH (DE) 1994-02-09 CN disclosed
US-5235096-A Hydroxybenzenesulfone compound having a polymerizable group and process for producing the same FUJI PHOTO FILM CO., LTD. (JP) 1993-08-10 US disclosed
EP-0460496-A1 Tetra-amino-anthraquinone dyes BASF Aktiengesellschaft (DE) 1991-12-11 EP disclosed
CN-1039797-A difluoromethyl compound MERCK PATENT GMBH (DE) 1990-02-21 CN 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-20240208990-A1 SPIRO-COMPOUNDS AND COMPOSITIONS INCLUDING THE SAME REN, PKD1, SAV1 TSHR 988/4885POLB 3985/4885APEX1 2681/4885
US-20240173211-A1 DENTAL RESIN-REINFORCED GLASS IONOMER CEMENT KIT GRIK1, GRIN2B, GRIK2 TSHR 2655/4885POLB 1327/4885APEX1 3533/4885

“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.