SCHEMBL3440797

SCHEMBL3440797

C=CC(=O)OCCOc1ccc(CCCc2ccc(OCCOC(=O)C=C)cc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.69
FFAR1 O14842 4/20 0.49
TSHR P16473 5/20 0.47
HPGD P15428 1/20 0.47
ALDH1A1 P00352 5/20 0.47
TP53 P04637 2/20 0.47
HIF1A Q16665 2/20 0.47
CYP3A4 P08684 2/20 0.47
HSD17B10 Q99714 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.43
LMNA P02545 2/20 0.43
PPARG P37231 1/20 0.43
PPARD Q03181 1/20 0.43
S1PR1 P21453 1/20 0.43
S1PR3 Q99500 1/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
CA5A P35218 1/20 0.42

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
SCHEMBL8031169 0.95 THRB (0.62) THRBFFAR1TSHRHPGDALDH1A1
SCHEMBL17036768 0.92 THRB (0.71) THRBFFAR1TSHRHPGDALDH1A1
SCHEMBL11032806 0.91 THRB (0.65) THRBTSHRHPGDALDH1A1HIF1A
SCHEMBL28297899 0.91 THRB (0.60) THRBFFAR1TSHRHPGDALDH1A1
SCHEMBL22451265 0.90 THRB (0.64) THRBFFAR1TSHRHPGDALDH1A1
SCHEMBL9489063 0.90 THRB (0.83) THRBTSHRHPGDALDH1A1TP53
SCHEMBL17036974 0.89 THRB (0.62) THRBFFAR1TSHRHPGDALDH1A1
SCHEMBL17791310 0.89 THRB (0.62) THRBFFAR1TSHRHPGDALDH1A1
SCHEMBL67525 0.89 THRB (0.70) THRBTSHRHPGDALDH1A1CYP3A4
SCHEMBL38654553 0.89 THRB (0.70) THRBTSHRHPGDALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009097152-A1 MULTIFUNCTIONAL ACRYLATES USED AS CROSS-LINKERS IN DENTAL AND BIOMEDICAL SELF-ETCHING BONDING ADHESIVES THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2009-08-06 WO claimed
US-10678156-B2 Pigment dispersion, method for manufacturing toner, aqueous ink, and triazo compound CANON KABUSHIKI KAISHA (JP) 2020-06-09 US disclosed
CN-105658732-A Metal effect pigments modified with a silane layer containing at least two different bifunctional silanes 舒伦克金属颜料有限公司 2016-06-08 CN disclosed
CN-101238183-B Metal effect pigments comprising a mixed inorganic/organic layer, method for the production of such metal effect pigments, and use thereof ECKART GMBH 2013-06-19 CN disclosed
US-7806050-B2 Ink composition, inkjet recording method, method of producing planographic printing plate, and planographic printing plate FUJIFILM CORPORATION (JP) 2010-10-05 US disclosed
US-20070182786-A1 Ink composition, inkjet recording method, method of producing planographic printing plate, and planographic printing plate FUJI PHOTO FILM CO., LTD. (JP) 2007-08-09 US disclosed
WO-2000069394-A1 ONE-PART FLUORIDE RELEASING DENTAL MATERIALS 3M INNOVATIVE PROPERTIES COMPANY (US) 2000-11-23 WO disclosed
EP-0305545-B1 SUBSTITUTED ACRIDINE DERIVATIVES AND THEIR USE Hitachi Chemical Co., Ltd. (JP) 1993-02-10 EP disclosed
US-5089377-A Acridin-9-yl acrylates ASAHI DENKA KOGYO K.K. (JP) 1992-02-18 US disclosed
US-5045433-A Photopolymerization initiators HITACHI CHEMICAL CO., LTD. (JP) 1991-09-03 US disclosed
US-4985564-A Acridine compound and photopolymerizable composition using the same HITACHI CHEMICAL CO., LTD. (JP) 1991-01-15 US disclosed
EP-0305545-A1 SUBSTITUTED ACRIDINE DERIVATIVES AND THEIR USE Hitachi Chemical Co., Ltd. (JP) 1989-03-08 EP disclosed
US-4774035-A WEAR RESISTANCE CAMELOT INDUSTRIES CORPORATION (US) 1988-09-27 US disclosed
US-4273802-A POLYFUNCTIONAL MONOMERS CONTAINING (METH)ACRYLOYLOXY GROUPS MITSUBISHI RAYON CO., LTD. (JP) 1981-06-16 US disclosed