SCHEMBL21340122

SCHEMBL21340122

CC(CCC(=O)O)(c1ccc(OCC2CO2)cc1)C1C=CC(OCC2CO2)=CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
TP53 P04637 3/20 0.46
TSHR P16473 3/20 0.46
MAPT P10636 2/20 0.46
HPGD P15428 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
HIF1A Q16665 2/20 0.46
CYP1A2 P05177 1/20 0.46
PPARG P37231 1/20 0.46
TDP1 Q9NUW8 1/20 0.37
PKM P14618 2/20 0.36
LMNA P02545 2/20 0.36
GAA P10253 1/20 0.36
GRM2 Q14416 1/20 0.33
SMN1; SMN2 Q16637 5/20 0.33
ITGB3 P05106 1/20 0.32
ITGA2B P08514 1/20 0.32
NPC1 O15118 4/20 0.32
RAB9A P51151 4/20 0.32

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
SCHEMBL24168299 0.81 ALDH1A1 (0.57) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL21661578 0.78 ALDH1A1 (0.53) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL21330554 0.77 ALDH1A1 (0.61) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL18678589 0.75 ALDH1A1 (0.54) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL18637640 0.73 ALDH1A1 (0.42) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL24677281 0.73 ALDH1A1 (0.52) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL11591190 0.72 ALDH1A1 (0.68) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL22461635 0.71 TP53 (0.51) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL15085274 0.71 ESR2 (0.50) ALDH1A1TSHRHPGDHIF1ALMNA
Acrylic Acid SCHEMBL1408546 0.68 ALDH1A1 (0.74) ALDH1A1TP53TSHRMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3532463-B1 SOLVENT-LESS IONIC LIQUID EPOXY RESIN UNIV ARIZONA STATE (US) 2023-10-04 EP disclosed
US-20220153922-A1 SOLVENT-LESS IONIC LIQUID EPOXY RESIN ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY 2022-05-19 US disclosed
US-20210363341-A1 SOLVENT-LESS IONIC LIQUID EPOXY RESIN ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY 2021-11-25 US disclosed
US-10975238-B2 Solvent-less ionic liquid epoxy resin ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2021-04-13 US disclosed
US-20190276662-A1 SOLVENT-LESS IONIC LIQUID EPOXY RESIN ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY 2019-09-12 US disclosed