SCHEMBL22590337

SCHEMBL22590337

COCCOCCOCCOCC(C)(O)c1ccc(C(C)(O)COCCOCCOCCOC)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.38
ALDH1A1 P00352 3/20 0.33
KMT2A Q03164 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
MEN1 O00255 2/20 0.33
HTT P42858 2/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
TSHR P16473 1/20 0.32
ACHE P22303 1/20 0.32
ABCB11 O95342 1/20 0.31
CYP3A4 P08684 1/20 0.31
ADRA2B P18089 1/20 0.31
OPRD1 P41143 1/20 0.31
SCN5A Q14524 1/20 0.31
LIPC P11150 1/20 0.30
LIPG Q9Y5X9 1/20 0.30
CNR2 P34972 1/20 0.30
KDM4E B2RXH2 3/20 0.30
RECQL P46063 1/20 0.30

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
SCHEMBL22590327 1.00 AOC3 (0.38) AOC3ALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL23080083 0.93 AOC3 (0.34) AOC3ALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL22779000 0.86 ESR1 (0.33) AOC3KMT2AMEN1PTPN2PTPN1
SCHEMBL22567871 0.86 ESR1 (0.33) ALDH1A1SMN1; SMN2TSHRCNR2KDM4E
SCHEMBL22590332 0.86 ESR1 (0.33) ALDH1A1SMN1; SMN2TSHRCNR2KDM4E
SCHEMBL22590329 0.85 ALDH1A1 (0.38) AOC3ALDH1A1KMT2AMEN1HTT
SCHEMBL22590328 0.85 HPGD (0.34) AOC3ALDH1A1SMN1; SMN2RAB9ATSHR
SCHEMBL22590325 0.81 ALDH1A1 (0.42) AOC3ALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL22590338 0.81 ALDH1A1 (0.42) AOC3ALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL23080100 0.81 PTPRC (0.31) SMN1; SMN2MAPTABCB11CYP3A4ADRA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4025553-A1 A PROCESS TO MAKE AROMATIC ENOL ETHERS AND OLEFIN ISOMERS OF AROMATIC ENOL ETHERS Eastman Chemical Company (US) 2022-07-13 EP disclosed
EP-4025639-A1 AROMATIC DICARBINOLS Eastman Chemical Company (US) 2022-07-13 EP disclosed
US-11312873-B2 Aromatic enol ether paint additives EASTMAN CHEMICAL COMPANY 2022-04-26 US disclosed
CN-114096507-A Aromatic dimethanol 伊士曼化工公司 2022-02-25 CN disclosed
CN-114072373-A Method for preparing aromatic enol ether and olefin isomer of aromatic enol ether 伊士曼化工公司 2022-02-18 CN disclosed
WO-2021046008-A1 AROMATIC DICARBINOLS EASTMAN CHEMICAL COMPANY (US) 2021-03-11 WO disclosed
WO-2021046010-A1 A PROCESS TO MAKE AROMATIC ENOL ETHERS AND OLEFIN ISOMERS OF AROMATIC ENOL ETHERS EASTMAN CHEMICAL COMPANY (US) 2021-03-11 WO disclosed
WO-2021046037-A1 AROMATIC ENOL ETHER PAINT ADDITIVES EASTMAN CHEMICAL COMPANY (US) 2021-03-11 WO disclosed
US-20210062016-A1 AROMATIC ENOL ETHER PAINT ADDITIVES EASTMAN CHEMICAL COMPANY (US) 2021-03-04 US disclosed
US-10865172-B1 Aromatic enol ethers EASTMAN CHEMICAL COMPANY (US) 2020-12-15 US disclosed
US-10865171-B1 Process to make aromatic enol ethers and olefin isomers of aromatic enol ethers EASTMAN CHEMICAL COMPANY (US) 2020-12-15 US disclosed
US-10815179-B1 Aromatic dicarbinols EASTMAN CHEMICAL COMPANY (US) 2020-10-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10865171-B1 Process to make aromatic enol ethers and olefin isomers of aromatic enol ethers ETV1, OSBPL8, ENY2 AOC3 253/4885ALDH1A1 4039/4885KMT2A 920/4885
US-11312873-B2 Aromatic enol ether paint additives EED, VCL, MAPT AOC3 1108/4885ALDH1A1 3784/4885KMT2A 123/4885
US-20210062016-A1 AROMATIC ENOL ETHER PAINT ADDITIVES EED, VCL, MAPT AOC3 1108/4885ALDH1A1 3784/4885KMT2A 123/4885
US-10865172-B1 Aromatic enol ethers ETV1, EED, VCL AOC3 696/4885ALDH1A1 3873/4885KMT2A 599/4885
US-10815179-B1 Aromatic dicarbinols DDC, GNPAT, ACAT2 AOC3 495/4885ALDH1A1 632/4885KMT2A 620/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.