SCHEMBL13324328

SCHEMBL13324328

Cc1cc(OCCO)c(C)cc1OCCO

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOX P28300 1/20 0.42
AOC3 Q16853 1/20 0.42
RARB P10826 1/20 0.41
TSHR P16473 3/20 0.40
IDO1 P14902 1/20 0.39
ALDH1A1 P00352 4/20 0.39
RECQL P46063 1/20 0.39
KMT2A Q03164 3/20 0.39
THRB P10828 1/20 0.39
TUBB1 Q9H4B7 1/20 0.39
GAA P10253 3/20 0.37
POLB P06746 3/20 0.37
NPSR1 Q6W5P4 1/20 0.37
KDM4E B2RXH2 3/20 0.36
NR1I2 O75469 1/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
CYP1A2 P05177 3/20 0.35
CYP2D6 P10635 2/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL3193061 0.88 RARB (0.36) LOXAOC3RARBTSHRIDO1
SCHEMBL11706798 0.88 TSHR (0.43) LOXAOC3RARBTSHRIDO1
SCHEMBL4816938 0.88 GALR3 (0.44) LOXAOC3RARBTSHRALDH1A1
SCHEMBL3342982 0.83 TSHR (0.43) LOXAOC3RARBTSHRIDO1
SCHEMBL12000686 0.83 LOX (0.40) LOXAOC3RARBTSHRIDO1
SCHEMBL516010 0.81 TSHR (0.64) TSHRALDH1A1KMT2AGAAPOLB
SCHEMBL7056362 0.81 L3MBTL1 (0.55) TSHRALDH1A1KMT2AKDM4EHTT
SCHEMBL15760677 0.79 NPSR1 (0.42) RARBTSHRALDH1A1KMT2AGAA
SCHEMBL9651856 0.79 IDO1 (0.44) IDO1KMT2ATUBB1KDM4EMAPT
SCHEMBL455549 0.79 ALDH1A1 (0.41) LOXAOC3TSHRALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230303767-A1 Resin and Preparation Method Therefor LG CHEM, LTD. (KR) 2023-09-28 US disclosed
US-7708820-B2 Black ink composition, ink set containing the same, and ink jet recording method FUJIFILM CORPORATION (JP) 2010-05-04 US disclosed
US-7527684-B2 Ink set and ink jet recording method FUJIFILM CORPORATION (JP) 2009-05-05 US disclosed
US-7520928-B2 Black ink composition, ink set containing the same, and ink jet recording method FUJIFILM CORPORATION (JP) 2009-04-21 US disclosed
US-7503966-B2 Black ink composition and ink jet recording method FUJIFILM CORPORATION (JP) 2009-03-17 US disclosed
US-20080043078-A1 Ink Set and Ink Jet Recording Method FUJIFILM CORPORATION (JP) 2008-02-21 US disclosed
US-20080043079-A1 Black Ink Composition, Ink Set Containing the Same, and Ink Jek Recording Method FUJIFILM CORPORATION (JP) 2008-02-21 US disclosed
US-20070240608-A1 Black Ink Composition, Ink Set Containing the Same, and Ink Jet Recording Method FUJIFILM CORPORATION (JP) 2007-10-18 US disclosed
US-20070139499-A1 Black ink composition and ink jet recording method FUJI PHOTO FILM CO., LTD. (JP) 2007-06-21 US disclosed