SCHEMBL26908643

SCHEMBL26908643

COc1cc(C(=O)OOC(=O)c2ccc(O)c(OC)c2)ccc1O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.72
MEN1 O00255 4/20 0.72
SLC22A6 Q4U2R8 1/20 0.72
SLC22A8 Q8TCC7 1/20 0.72
RAB9A P51151 1/20 0.72
HTT P42858 1/20 0.70
HSD17B2 P37059 1/20 0.70
KDM4E B2RXH2 1/20 0.66
POLB P06746 1/20 0.66
HDAC6 Q9UBN7 1/20 0.66
CYP1A2 P05177 1/20 0.58
HSP90AA1 P07900 1/20 0.58
HSP90AB1 P08238 1/20 0.58
BLM P54132 1/20 0.58
CYP2D6 P10635 1/20 0.57
ALDH1A1 P00352 2/20 0.54
GAA P10253 2/20 0.54
HPGD P15428 2/20 0.54
HSD17B10 Q99714 2/20 0.54
MAPT P10636 1/20 0.54

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
Methyl Vanillate SCHEMBL31157843 0.89 KMT2A (0.72) KMT2AMEN1SLC22A6SLC22A8RAB9A
Methyl Vanillate SCHEMBL25417789 0.89 KMT2A (0.72) KMT2AMEN1SLC22A6SLC22A8RAB9A
Methyl Vanillate SCHEMBL275939 0.89 KMT2A (0.72) KMT2AMEN1SLC22A6SLC22A8RAB9A
Methyl Vanillate SCHEMBL29640509 0.89 KMT2A (0.72) KMT2AMEN1SLC22A6SLC22A8RAB9A
SCHEMBL13809188 0.85 KMT2A (0.68) KMT2AMEN1SLC22A6SLC22A8RAB9A
SCHEMBL8778631 0.84 TSHR (0.70) KMT2AMEN1RAB9AKDM4EPOLB
SCHEMBL15814046 0.84 SLC22A6 (1.00) KMT2AMEN1SLC22A6SLC22A8RAB9A
SCHEMBL15289000 0.84 MEN1 (1.00) KMT2AMEN1SLC22A6SLC22A8RAB9A
SCHEMBL29532454 0.84 MEN1 (1.00) KMT2AMEN1SLC22A6SLC22A8RAB9A
SCHEMBL9553296 0.84 KMT2A (0.66) KMT2AMEN1SLC22A6SLC22A8RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240101742-A1 LIVING RADICAL POLYMER, COMPOSITION, RESIN-COATED PIGMENT, AND METHOD FOR PRODUCING LIVING RADICAL POLYMER NOF CORPORATION (JP) 2024-03-28 US disclosed
EP-4286422-A1 LIVING RADICAL POLYMER, COMPOSITION, RESIN-COATED PIGMENT, AND METHOD FOR PRODUCING LIVING RADICAL POLYMER NOF Corporation (JP) 2023-12-06 EP disclosed
CN-116745366-A Reactive radical polymer, composition, resin-coated pigment, and method for producing reactive radical polymer 日油株式会社 2023-09-12 CN disclosed