SCHEMBL2700837

SCHEMBL2700837

CC(=Cc1c(C(=O)O)c(C(=O)O)c(C=C(C)C(=O)O)c(C(=O)O)c1C(=O)O)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.46
APEX1 P27695 10/20 0.37
PTGS1 P23219 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
NR4A2 P43354 1/20 0.32
RXRG P48443 1/20 0.32
HTT P42858 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPT P10636 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
SCHEMBL124743 0.77 AKR1C3 (0.48) AKR1C3APEX1PTGS1RXRARXRB
SCHEMBL124742 0.77 AKR1C3 (0.48) AKR1C3APEX1PTGS1RXRARXRB
SCHEMBL124240 0.73 AKR1C3 (0.45) AKR1C3APEX1PTGS1RXRARXRB
SCHEMBL263472 0.73 AKR1C3 (0.45) AKR1C3APEX1PTGS1
SCHEMBL466254 0.73 AKR1C3 (0.45) AKR1C3APEX1PTGS1
SCHEMBL124241 0.73 AKR1C3 (0.45) AKR1C3APEX1PTGS1RXRARXRB
SCHEMBL632365 0.69 AKR1C3 (0.45) AKR1C3APEX1RXRARXRBNR4A2
SCHEMBL122734 0.69 AKR1C3 (0.45) AKR1C3APEX1CYP3A4MAPT
SCHEMBL122735 0.69 AKR1C3 (0.45) AKR1C3APEX1CYP3A4MAPT
SCHEMBL9283066 0.69 AKR1C3 (0.55) AKR1C3APEX1RXRARXRBNR4A2

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2475725-B2 REMOVABLE COLOR GEL BASECOAT FOR ARTIFICIAL NAIL COATINGS AND METHODS THEREFORE BRANDCO CND 2020 LLC (US) 2023-08-02 EP claimed
EP-3029114-B1 SYSTEM FOR COVERING A NAIL SURFACE CREATIVE NAIL DESIGN INC (US) 2021-03-03 EP claimed
EP-3782599-A1 DENTAL POLYMERIZABLE COMPOSITION BASED ON CONDENSED SILANES VOCO GmbH (DE) 2021-02-24 EP claimed
EP-2475725-B1 REMOVABLE COLOR GEL BASECOAT FOR ARTIFICIAL NAIL COATINGS AND METHODS THEREFORE CREATIVE NAIL DESIGN INC (US) 2015-11-11 EP claimed
EP-3782599-A1 DENTAL POLYMERIZABLE COMPOSITION BASED ON CONDENSED SILANES VOCO GmbH (DE) 2021-02-24 EP disclosed
EP-2716276-B1 Kit and method for indirect chair-side production of composite inlays VOCO GMBH (DE) 2019-04-24 EP disclosed
EP-2578200-B1 Compounds for infiltrating and/or sealing of dental hard substance and method VOCO GMBH (DE) 2018-03-28 EP disclosed
EP-2436363-B1 Compound comprising a monomer with a polyalicyclic structure element for filling and/or sealing a root canal VOCO GMBH (DE) 2017-01-18 EP disclosed
EP-2578200-A1 Compounds for infiltrating and/or sealing of dental hard substance and method VOCO GmbH (DE) 2013-04-10 EP disclosed
EP-2436668-B1 Polymerisable compounds comprising a polyalicyclic structure element VOCO GMBH (DE) 2012-09-12 EP disclosed
EP-2450025-A1 Polymerisable phosphoric acid derivatives comprising a polyalicyclic structure element VOCO GmbH (DE) 2012-05-09 EP disclosed
EP-2436668-A1 Polymerisable compounds comprising a polyalicyclic structure element VOCO GmbH (DE) 2012-04-04 EP disclosed
EP-0782591-B1 POLYMERISABLE OLIGO AND/OR POLYALKENE ACIDS MUEHLBAUER ERNST KG (DE) 1999-01-07 EP disclosed