SCHEMBL1228461

SCHEMBL1228461

[CH2]CCCCCCCCCCCOC(=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
SCHEMBL33312 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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4324450-A1 DENTAL FILLING KIT Kuraray Noritake Dental Inc. (JP) 2024-02-21 EP disclosed
EP-3936109-A1 SOLVENT-FREE ADHESIVE COMPOSITION FOR DENTAL USE Kuraray Noritake Dental Inc. (JP) 2022-01-12 EP disclosed
EP-3884920-A1 DENTAL CLEANING MATERIAL AND DENTAL TEMPORARY ADHESIVE MATERIAL REMOVAL MATERIAL Kuraray Noritake Dental Inc. (JP) 2021-09-29 EP disclosed
EP-3808325-A1 PHOTOPOLYMERIZABLE TYPE DENTAL SURFACE COATING COMPOSITION Shofu Inc. (JP) 2021-04-21 EP disclosed
US-8496849-B2 Liquid crystal aligning agent, liquid crystal alignment film and liquid crystal display device JSR CORPORATION (JP) 2013-07-30 US disclosed
EP-2256541-B1 A LIQUID CRYSTAL ORIENTATING AGENT, A LIQUID CRYSTAL ORIENTATING FILM AND A LIQUID CRYSTAL DISPLAY ELEMENT JSR CORP (JP) 2012-12-05 EP disclosed
US-20110043739-A1 LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY DEVICE JSR CORPORATION (JP) 2011-02-24 US disclosed
EP-2256541-A1 A LIQUID CRYSTAL ORIENTATING AGENT, A LIQUID CRYSTAL ORIENTATING FILM AND A LIQUID CRYSTAL DISPLAY ELEMENT JSR Corporation (JP) 2010-12-01 EP disclosed
EP-2226060-A1 CEMENT FOR DENTAL APPLICATIONS Kuraray Medical Inc. (JP) 2010-09-08 EP disclosed
CN-101534785-A Dental oral composition UNIV OKAYAMA NAT UNIV CORP (JP) 2009-09-16 CN disclosed
US-6071983-A FOR TREATING TOOTH SURFACE BY FACILE HANDLING; FOR RESTORING A TOOTH-SURFACE WITH COATING MATERIAL OR RESTORING DENTAL RESTORATIVE RESINS SUN MEDICAL CO., LTD. (JP) 2000-06-06 US disclosed
US-5834532-A BLEND OF POLYMERIZABLE MONOMER HAVING ACIDIC GROUPS AND AN INITIATOR SUN MEDICAL CO., LTD. (JP) 1998-11-10 US disclosed
US-5587406-A APPLYING CURABLE PRIMER COMPOSITION COMPRISING POLYMERIZABLE MONOMER HAVING ACID GROUP AND POLYMERIZABLE MONOMER HAVING HYDROXYL GROUP AND POLYMERIZATION INITIATOR TO TOOTH SUN MEDICAL CO., LTD. (JP) 1996-12-24 US disclosed
US-5530038-A CONTAINING UNSATURATED MONOMER WITH ACIDIC GROUP, UNSATURATED MONOMER WITH HYDROXYL GROUP, POLYMERIZATION INITIATOR, AMINE COMPOUND, ZIRCONIUM OXIDE AND ORGANIC COMPOSITE FILLERS SUN MEDICAL CO., LTD. (JP) 1996-06-25 US 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