SCHEMBL364685

SCHEMBL364685

C=C(CCC1CO1)C(=O)Oc1ccc(C(C)(C)c2ccc(O)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.45
HPGD P15428 3/20 0.45
TSHR P16473 3/20 0.45
MAPT P10636 3/20 0.45
TP53 P04637 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
CYP1A2 P05177 1/20 0.45
PPARG P37231 1/20 0.45
HIF1A Q16665 1/20 0.45
MIF P14174 2/20 0.39
ESR1 P03372 4/20 0.37
ESR2 Q92731 4/20 0.37
CYP3A4 P08684 3/20 0.37
AR P10275 1/20 0.37
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
HTR6 P50406 1/20 0.37
ESRRG P62508 1/20 0.37
SLC6A3 Q01959 1/20 0.37

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
SCHEMBL11861222 0.81 ALDH1A1 (0.46) ALDH1A1HPGDTSHRMAPTTP53
SCHEMBL3389975 0.81 KMT2A (0.44) ALDH1A1HPGDTSHRMAPTTP53
SCHEMBL7923720 0.81 KMT2A (0.50) ALDH1A1HPGDTSHRMAPTTP53
SCHEMBL1255106 0.81 ALDH1A1 (0.44) ALDH1A1HPGDTSHRMAPTTP53
SCHEMBL9064827 0.79 ESR1 (0.47) ALDH1A1HPGDTSHRMIFESR1
SCHEMBL15991135 0.79 TDP1 (0.42) ALDH1A1MEN1KMT2AELANERAB9A
Methacrylic Acid SCHEMBL3864596 0.78 KMT2A (0.47) ALDH1A1HPGDTSHRMAPTTP53
SCHEMBL5157323 0.75 HPGD (0.43) ALDH1A1HPGDTSHRMAPTTP53
SCHEMBL12520495 0.75 ALDH1A1 (0.62) ALDH1A1HPGDTSHRMAPTTP53
SCHEMBL9237285 0.74 ALDH1A1 (0.45) ALDH1A1HPGDTSHRMAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3761941-B1 BIOACTIVE DENTAL RESTORATIVE MATERIAL WITH REMINERALIZATION PROPERTIES UNIV CALIFORNIA (US) 2024-05-01 EP claimed
EP-2981228-B1 ORTHODONTIC WIRE ALIGNMENT SYSTEM AND METHOD ALTA SMILES LLC (US) 2023-06-07 EP claimed
EP-2674145-B1 Self-etching dental adhesive compositions BISCO INC (US) 2022-06-15 EP claimed
EP-3706709-B1 DENTAL COMPOSITION WITH HIGH E-MODULUS 3M INNOVATIVE PROPERTIES CO (US) 2022-04-06 EP claimed
EP-3706708-B1 RADIOPAQUE DENTAL COMPOSITION 3M INNOVATIVE PROPERTIES CO (US) 2022-01-12 EP claimed
EP-3305341-B1 METHOD FOR PREPARING DENTAL COMPOSITE RESIN MATERIAL, AND PRODUCT PREPARED USING DENTAL COMPOSITE RESIN MATERIAL LIAONING UPCERA CO LTD (CN) 2021-09-29 EP claimed
US-11007302-B2 Auto-polymerizable prosthetic material and polymerized, fracture-tough prosthetic material with increased colour stability KULZER GMBH (DE) 2021-05-18 US claimed
EP-2114292-B1 RESIN REINFORCED ZINC POLYCARBOXYLATE TEMPORARY CEMENT COMPOSITIONS AND RELATED KITS ULTRADENT PRODUCTS INC (US) 2020-04-29 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-2496240-B1 COMPOSITIONS OF APATITE AND METHODS OF USE UNIV MICHIGAN REGENTS (US) 2018-09-26 EP claimed
EP-1214042-A1 AUTOPOLYMERIZING PROSTHETICAL AND REBASE MATERIALS AND THEIR USE VOCO GmbH (DE) 2002-06-19 EP claimed
EP-0803240-B1 Polymerisable dental material containing a filler IVOCLAR VIVADENT AG (LI) 2002-06-19 EP claimed
EP-1213005-A1 Composition for priming dental and biological substrates ULTRADENT PRODUCTS, INC. (US) 2002-06-12 EP claimed
EP-0685454-B2 X-ray opaque dental materials IVOCLAR VIVADENT AG (LI) 2001-06-27 EP claimed
WO-2001017482-A1 AUTOPOLYMERIZING PROSTHETICAL AND REBASE MATERIALS AND THEIR USE VOCO GMBH (DE) 2001-03-15 WO claimed
EP-0971678-A2 DENTAL COMPOSITE RESTORATIVE MATERIAL AND METHOD OF RESTORING A TOOTH DENTSPLY INTERNATIONAL, INC. (US) 2000-01-19 EP claimed
WO-1998043596-A2 DENTAL COMPOSITE RESTORATIVE MATERIAL AND METHOD OF RESTORING A TOOTH DENTSPLY INTERNATIONAL INC. (US) 1998-10-08 WO claimed
EP-0803240-A2 Polymerisable dental material containing a filler IVOCLAR AG (LI) 1997-10-29 EP claimed
EP-0685454-B1 X-ray opaque dental materials IVOCLAR AG (LI) 1997-10-15 EP claimed
EP-0685454-A1 X-ray opaque dental materials IVOCLAR AG (LI) 1995-12-06 EP claimed