SCHEMBL21628044

SCHEMBL21628044

CC(C=O)c1cccc(C(C)C=O)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 3/20 0.38
HDAC8 Q9BY41 3/20 0.38
TYR P14679 3/20 0.38
MAPT P10636 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
CYP3A4 P08684 2/20 0.38
HPGD P15428 2/20 0.38
HDAC2 Q92769 2/20 0.38
MDM4 O15151 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
TP53 P04637 1/20 0.38
ALOX15 P16050 1/20 0.38
ALOX12 P18054 1/20 0.38
CA5A P35218 1/20 0.38
HTT P42858 1/20 0.38
MDM2 Q00987 1/20 0.38
CA9 Q16790 1/20 0.38

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
SCHEMBL31490296 0.87 ACP3 (0.44) ALDH1A1HPGDTP53TDP1MAPK1
SCHEMBL9870224 0.87 ACP3 (0.44) ALDH1A1HPGDTP53TDP1MAPK1
SCHEMBL4437155 0.85 ALDH1A1 (0.45) MAPTSMN1; SMN2ALDH1A1HTTMEN1
SCHEMBL27573550 0.85 CYP3A4 (0.42) ALDH1A1CYP3A4CA1CA2CA9
SCHEMBL97561 0.85 HDAC4 (0.44) HDAC4KDM4E
SCHEMBL7510418 0.85 ACP3 (0.43) ALDH1A1HPGDMEN1KMT2AADRB1
SCHEMBL7008264 0.85 ADRB1 (0.52) HDAC4HDAC8TYRMAPTSMN1; SMN2
SCHEMBL31477036 0.84 PTGS2 (0.56) MAPTSMN1; SMN2KDM4EALDH1A1CYP3A4
SCHEMBL7564603 0.83 RXRA (0.49) HDAC4HDAC8HDAC2PTGS2RXRA
Benzene SCHEMBL28222842 0.83 UNG (0.44) TYRALDH1A1CA1CA2CA9

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022076359-A1 A PROCESS FOR MAKING ENOL ETHERS EASTMAN CHEMICAL COMPANY (US) 2022-04-14 WO claimed
CN-114364753-B Aromatic enol ether paint additive 伊士曼化工公司 2023-08-04 CN disclosed
EP-4025552-A1 AROMATIC ENOL ETHERS Eastman Chemical Company (US) 2022-07-13 EP disclosed
EP-4025554-A1 METHOD OF MAKING A DIALDEYHDE EASTMAN CHEMICAL COMPANY (US) 2022-07-13 EP disclosed
EP-4025555-A1 METHOD OF MAKING A DIALDEYHDE Eastman Chemical Company (US) 2022-07-13 EP disclosed
EP-4025654-A1 AROMATIC ENOL ETHER PAINT ADDITIVES EASTMAN CHEMICAL COMPANY (US) 2022-07-13 EP disclosed
WO-2022125856-A1 AROMATIC ENOL ETHERS EASTMAN CHEMICAL COMPANY (US) 2022-06-16 WO disclosed
US-11312873-B2 Aromatic enol ether paint additives EASTMAN CHEMICAL COMPANY 2022-04-26 US disclosed
US-11312873-B2 Aromatic enol ether paint additives EASTMAN CHEMICAL COMPANY 2022-04-26 US disclosed
CN-114364753-A Aromatic enol ether paint additive 伊士曼化工公司 2022-04-15 CN disclosed
WO-2021046011-A1 METHOD OF MAKING A DIALDEYHDE EASTMAN CHEMICAL COMPANY (US) 2021-03-11 WO disclosed
WO-2021046007-A1 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-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-10550057-B1 Method of making a dialdeyhde EASTMAN CHEMICAL COMPANY (US) 2020-02-04 US disclosed
US-10550057-B1 Method of making a dialdeyhde EASTMAN CHEMICAL COMPANY (US) 2020-02-04 US disclosed
US-10544076-B1 Method of making a dialdeyhde EASTMAN CHEMICAL COMPANY (US) 2020-01-28 US disclosed
US-10544076-B1 Method of making a dialdeyhde EASTMAN CHEMICAL COMPANY (US) 2020-01-28 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-10544076-B1 Method of making a dialdeyhde DERA, SORD, DDT HDAC4 2905/4885HDAC8 1558/4885TYR 3163/4885
US-11312873-B2 Aromatic enol ether paint additives EED, VCL, MAPT HDAC4 1350/4885HDAC8 220/4885TYR 4/4885
US-20210062016-A1 AROMATIC ENOL ETHER PAINT ADDITIVES EED, VCL, MAPT HDAC4 1350/4885HDAC8 220/4885TYR 4/4885
US-10865172-B1 Aromatic enol ethers ETV1, EED, VCL HDAC4 1435/4885HDAC8 228/4885TYR 4/4885
US-10550057-B1 Method of making a dialdeyhde ADH1C, DERA, DDT HDAC4 3381/4885HDAC8 2343/4885TYR 983/4885

“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.