SCHEMBL1361722

SCHEMBL1361722

CCCCCCCCOc1ccc(I)c(-c2ccccc2)c1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.55
HDAC8 Q9BY41 2/20 0.53
LTA4H P09960 2/20 0.53
PTPN11 Q06124 5/20 0.52
SOAT1 P35610 1/20 0.51
TSHR P16473 1/20 0.49
NR5A1 Q13285 1/20 0.46
PDK2 Q15119 1/20 0.46
PLA2G4B P0C869 1/20 0.46
RARB P10826 1/20 0.46

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
SCHEMBL2151879 0.89 NR5A1 (0.53) LTA4HPTPN11TSHRNR5A1PLA2G4B
SCHEMBL5057429 0.88 PTPN1 (0.61) PTPN1HDAC8LTA4HPTPN11SOAT1
SCHEMBL6866588 0.84 HDAC8 (0.55) PTPN1HDAC8LTA4HPTPN11SOAT1
SCHEMBL6933540 0.83 LTA4H (0.54) LTA4HPTPN11TSHRNR5A1PLA2G4B
SCHEMBL7874461 0.83 LTA4H (0.54) LTA4HPTPN11TSHRNR5A1PLA2G4B
SCHEMBL7874436 0.83 LTA4H (0.54) LTA4HPTPN11TSHRNR5A1PLA2G4B
SCHEMBL145007 0.83 LTA4H (0.54) LTA4HPTPN11TSHRNR5A1PLA2G4B
SCHEMBL27670055 0.82 PTPN1 (0.58) PTPN1HDAC8LTA4HPTPN11SOAT1
SCHEMBL17388694 0.82 PTPN11 (0.59) PTPN1HDAC8LTA4HPTPN11SOAT1
SCHEMBL7941538 0.82 PTPN11 (0.59) PTPN1HDAC8LTA4HPTPN11SOAT1

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
US-8785514-B2 Dual-cure dental resins and adhesives with increased cure and color stability and low color THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2014-07-22 US disclosed
US-8067481-B2 Low shrinkage dental material and method DENTSPLY INTERNATIONAL, INC. (US) 2011-11-29 US disclosed
US-20110200973-A1 Light- and Dual-Cure Dental Resins and Adhesives With Increased Cure and Color Stability and Low Color BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2011-08-18 US disclosed
US-20100286435-A1 Low shrinkage dental material and method SUN BENJAMIN JIEMIN 2010-11-11 US disclosed
US-7582391-B2 Two-photon absorption decolorizable material, two-photon absorption refractive index modulation material, two-photon absorption polymerization material, two-photon absorption polymerization method and three-dimensional optical recording material FUJIFILM CORPORATION (JP) 2009-09-01 US disclosed
WO-2009073570-A2 LIGHT- AND DUAL-CURE DENTAL RESINS AND ADHESIVES WITH INCREASED CURE AND COLOR-STABILITY, AND LOW COLOR BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2009-06-11 WO disclosed
US-20060194896-A1 Low shrinkage dental material and method SUN BENJAMIN J 2006-08-31 US disclosed
US-20060083890-A1 Two-photon absorption decolorizable material, two-photon absorption refractive index modulation material, two-photon absorption polymerization material, two-photon absorption polymerization method and three-dimensional optical recording material FUJI PHOTO FILM CO., LTD. (JP) 2006-04-20 US disclosed
US-20060057467-A1 Hologram recording material and hologram recording method FUJI PHOTO FILM CO., LTD. 2006-03-16 US disclosed
US-20050046915-A1 Hologram recording material composition, hologram recording material and hologram recording method FUJI PHOTO FILM CO., LTD. 2005-03-03 US disclosed
EP-1508833-A2 Hologram recording material composition, hologram recording material and hologram recording method FUJI PHOTO FILM CO., LTD. (JP) 2005-02-23 EP disclosed
EP-0526284-A1 Photopolymerizable, red-sensitive compositions, useful for recording holograms CENTRE NATIONAL D'ETUDES SPATIALES (FR) 1993-02-03 EP disclosed
WO-1993001526-A1 RED-SENSITIVE PHOTOPOLYMERIZABLE COMPOSITIONS FOR RECORDING HOLOGRAMS CENTRE NATIONAL D'ETUDES SPATIALES (FR) 1993-01-21 WO disclosed