SCHEMBL33450

SCHEMBL33450

C=C(C)C(=O)OCCc1[c]cccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.44
POLB P06746 1/20 0.43
APEX1 P27695 1/20 0.43
HTT P42858 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
TSHR P16473 5/20 0.39
ELANE P08246 1/20 0.38
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
KMT2A Q03164 2/20 0.33
ATM Q13315 1/20 0.33
ALDH1A1 P00352 3/20 0.33
MAPT P10636 2/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
LMNA P02545 2/20 0.31
TP53 P04637 1/20 0.31
RAD52 P43351 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL4950927 0.91 TDP1 (0.47) THRBPOLBAPEX1HTTTDP1
SCHEMBL27773558 0.90 TDP1 (0.49) THRBPOLBAPEX1HTTTDP1
SCHEMBL10352518 0.84 TSHR (0.37) THRBPOLBAPEX1HTTTDP1
SCHEMBL5776915 0.84 RAD52 (0.43) TSHRKMT2AALDH1A1NPC1RAB9A
SCHEMBL5032141 0.81 THRB (0.42) THRBPOLBAPEX1HTTTDP1
SCHEMBL8027133 0.80 THRB (0.40) THRBPOLBAPEX1HTTTDP1
SCHEMBL2638223 0.76 THRB (0.39) THRBPOLBAPEX1HTTTDP1
SCHEMBL42893 0.76 HCAR2 (0.51) THRBPOLBAPEX1HTTTDP1
SCHEMBL21371 0.74 TDP1 (0.61) THRBPOLBAPEX1HTTTDP1
Methane SCHEMBL4468486 0.74 HCAR2 (0.50) THRBPOLBAPEX1HTTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2492289-B1 POLYMERIZABLE COMPOSITION AND DENTAL MATERIAL KURARAY NORITAKE DENTAL INC (JP) 2020-03-18 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-2628476-B1 FILLER CONTAINING COMPOSITION AND PROCESS FOR PRODUCTION AND USE THEREOF 3M INNOVATIVE PROPERTIES CO (US) 2018-03-28 EP claimed
EP-2248835-B1 CURABLE COMPOSITION KANEKA CORP (JP) 2015-10-14 EP claimed
CN-101256360-B Radiosensitive resin composition, laminated insulation film and micro lens, preparation method thereof JSR CORP 2012-06-20 CN 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
US-6916858-B2 Dental adhesive composition GC CORPORATION (JP) 2005-07-12 US claimed
US-6326417-B1 CONTAINING SALICYLIC ACID COMPOUND AS MICROBIOCIDES JENERIC/PENTRON INCORPORATED 2001-12-04 US claimed
EP-3848418-B1 DENTAL CURABLE COMPOSITION AND METHOD FOR PRODUCING DENTAL CURABLE COMPOSITION TOKUYAMA DENTAL CORP (JP) 2024-05-22 EP disclosed
EP-3848418-A1 COMPOSITE MATERIAL, CURABLE COMPOSITION, AND METHOD FOR PRODUCING CURABLE COMPOSITION Tokuyama Dental Corporation (JP) 2021-07-14 EP disclosed
CN-109814335-A Photosensitive composition, colour filter and image display device 东友精细化工有限公司 2019-05-28 CN disclosed
EP-1973587-B1 METHODS AND SYSTEMS FOR PREPARING ANTIMICROBIAL FILMS AND COATINGS ALLACCEM INC (US) 2019-02-06 EP disclosed
CN-108628100-A Red pixel photosensitive composition, colour filter and its application 东友精细化工有限公司 2018-10-09 CN disclosed
EP-1051961-A1 Bonding compositions for dental use KURARAY CO., LTD. (JP) 2000-11-15 EP 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
CN-1115768-A Particles of cross-linked anion exchange agent and production of same ROM AND HARS CO LTD (US) 1996-01-31 CN disclosed