SCHEMBL3389900

SCHEMBL3389900

OCC(O)C(O)C(O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 2/20 0.48
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 2/20 0.47
SLC6A2 P23975 2/20 0.45
SLC6A4 P31645 2/20 0.45
SLC6A3 Q01959 2/20 0.45
LMNA P02545 3/20 0.45
ADRA2C P18825 2/20 0.45
ADRA2A P08913 1/20 0.45
HIF1A Q16665 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.43
CHRM2 P08172 1/20 0.42
ADRA1A P35348 1/20 0.42
RGS12 O14924 1/20 0.42
GLA P06280 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
PKM P14618 1/20 0.42
ALOX15 P16050 1/20 0.42

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
SCHEMBL550790 1.00 AOC3 (0.48) AOC3ALDH1A1KDM4ESLC6A2SLC6A4
SCHEMBL551822 1.00 AOC3 (0.48) AOC3ALDH1A1KDM4ESLC6A2SLC6A4
SCHEMBL550791 1.00 AOC3 (0.48) AOC3ALDH1A1KDM4ESLC6A2SLC6A4
SCHEMBL27825950 0.91 TDP1 (0.50) AOC3ALDH1A1KDM4ESLC6A2SLC6A4
SCHEMBL5873439 0.91 TDP1 (0.50) AOC3ALDH1A1KDM4ESLC6A2SLC6A4
SCHEMBL4077892 0.91 TDP1 (0.50) AOC3ALDH1A1KDM4ESLC6A2SLC6A4
SCHEMBL30801376 0.91 SLC6A2 (0.54) AOC3ALDH1A1KDM4ESLC6A2SLC6A4
SCHEMBL117950 0.91 SLC6A2 (0.54) AOC3ALDH1A1KDM4ESLC6A2SLC6A4
Alcohol SCHEMBL28032136 0.86 AOC3 (0.46) AOC3ALDH1A1KDM4ESLC6A2SLC6A4
Bicarbonate SCHEMBL27926290 0.84 SLC6A2 (0.48) AOC3ALDH1A1KDM4ESLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2152771-B2 PRODUCTION METHOD OF UNSATURATED (POLY)ALKYLENE GLYCOL ETHER MONOMER AND PRODUCTION METHOD OF (POLY)ALKYLENE GLYCOL CHAIN-CONTAINING POLYMER NIPPON CATALYTIC CHEM IND (JP) 2021-03-10 EP disclosed
EP-2152771-B1 PRODUCTION METHOD OF UNSATURATED (POLY)ALKYLENE GLYCOL ETHER MONOMER AND PRODUCTION METHOD OF (POLY)ALKYLENE GLYCOL CHAIN-CONTAINING POLYMER NIPPON CATALYTIC CHEM IND (JP) 2016-09-07 EP disclosed
US-8754264-B2 Production method of unsaturated (poly)alkylene glycol ether monomer and production method of (poly)alkylene glycol chain-containing polymer NIPPON SHOKUBAI CO., LTD. (JP) 2014-06-17 US disclosed
CN-101657479-B Method for producing unsaturated (poly) alkylene glycol ether monomer and method for producing (poly) alkylene glycol chain-containing polymer NIPPON CATALYTIC CHEM IND 2013-09-25 CN disclosed
CN-101331146-B Analogs of alpha galactosylceramide and uses thereof LUDWIG INST CANCER RES 2012-06-13 CN disclosed
US-20100130793-A1 PRODUCTION METHOD OF UNSATURATED (POLY)ALKYLENE GLYCOL ETHER MONOMER AND PRODUCTION METHOD OF (POLY)ALKYLENE GLYCOL CHAIN-CONTAINING POLYMER NIPPON SHOKUBAI CO. LTD (JP) 2010-05-27 US disclosed
CN-101657479-A Method for producing unsaturated (poly) alkylene glycol ether monomer and method for producing (poly) alkylene glycol chain-containing polymer NIPPON CATALYTIC CHEM IND JP 2010-02-24 CN disclosed
EP-2152771-A1 PRODUCTION METHOD OF UNSATURATED (POLY)ALKYLENE GLYCOL ETHER MONOMER AND PRODUCTION METHOD OF (POLY)ALKYLENE GLYCOL CHAIN-CONTAINING POLYMER Nippon Shokubai Co., Ltd. (JP) 2010-02-17 EP disclosed
CN-101331146-A Analogs of alpha galactosylceramide and uses thereof LUDWIG INST CANCER RES (US) 2008-12-24 CN disclosed
WO-2008126909-A1 PRODUCTION METHOD OF UNSATURATED (POLY)ALKYLENE GLYCOL ETHER MONOMER AND PRODUCTION METHOD OF (POLY)ALKYLENE GLYCOL CHAIN-CONTAINING POLYMER NIPPON SHOKUBAI CO., LTD. (JP) 2008-10-23 WO 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 (1 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-20100130793-A1 PRODUCTION METHOD OF UNSATURATED (POLY)ALKYLENE GLYCOL ETHER MONOMER AND PRODUCTION METHOD OF (POLY)ALKYLENE GLYCOL CHAIN-CONTAINING POLYMER ALOX12, ALOX5, DECR2 AOC3 1264/4885ALDH1A1 834/4885KDM4E 3218/4885

“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.