SCHEMBL5176035

SCHEMBL5176035

CCOCCCOCCCOCCCO

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.60
TSHR P16473 4/20 0.52
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
THRB P10828 1/20 0.46
HTT P42858 1/20 0.46
MAPT P10636 1/20 0.46
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 2/20 0.35
HSD17B10 Q99714 1/20 0.35
GAA P10253 1/20 0.33

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
SCHEMBL970031 1.00 ALDH1A1 (0.60) ALDH1A1TSHRMEN1KMT2ATHRB
SCHEMBL10057437 0.97 ALDH1A1 (0.57) ALDH1A1TSHRMEN1KMT2ATHRB
SCHEMBL10057436 0.97 ALDH1A1 (0.57) ALDH1A1TSHRMEN1KMT2ATHRB
SCHEMBL8934477 0.97 ALDH1A1 (0.63) ALDH1A1TSHRMEN1KMT2ATHRB
SCHEMBL10938078 0.94 ALDH1A1 (0.60) ALDH1A1TSHRMEN1KMT2ATHRB
SCHEMBL1769967 0.94 ALDH1A1 (0.60) ALDH1A1TSHRMEN1KMT2ATHRB
SCHEMBL4396037 0.94 ALDH1A1 (0.60) ALDH1A1TSHRMEN1KMT2ATHRB
SCHEMBL20067026 0.94 ALDH1A1 (0.60) ALDH1A1TSHRMEN1KMT2ATHRB
SCHEMBL4864 0.94
SCHEMBL4390929 0.92 ALDH1A1 (0.57) ALDH1A1TSHRMEN1KMT2ATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3720835-B1 METHOD FOR PREPARING ETHERS OF CYCLOALIPHATIC OR ARALIPHATIC DIOLS BASF SE (DE) 2022-07-13 EP claimed
US-11078146-B2 Method for preparing ethers of cycloaliphatic or araliphatic diols BASF SE (DE) 2021-08-03 US claimed
US-20210171427-A1 METHOD FOR PREPARING ETHERS OF CYCLOALIPHATIC OR ARALIPHATIC DIOLS BASF SE (DE) 2021-06-10 US claimed
CN-111479795-A Process for preparing ethers of cycloaliphatic or araliphatic diols 巴斯夫欧洲公司 2020-07-31 CN claimed
EP-3720835-B1 METHOD FOR PREPARING ETHERS OF CYCLOALIPHATIC OR ARALIPHATIC DIOLS BASF SE (DE) 2022-07-13 EP disclosed
US-11078146-B2 Method for preparing ethers of cycloaliphatic or araliphatic diols BASF SE (DE) 2021-08-03 US disclosed
US-20210171427-A1 METHOD FOR PREPARING ETHERS OF CYCLOALIPHATIC OR ARALIPHATIC DIOLS BASF SE (DE) 2021-06-10 US disclosed
EP-3720835-A1 METHOD FOR PREPARING ETHERS OF CYCLOALIPHATIC OR ARALIPHATIC DIOLS BASF SE (DE) 2020-10-14 EP disclosed
CN-111479795-A Process for preparing ethers of cycloaliphatic or araliphatic diols 巴斯夫欧洲公司 2020-07-31 CN disclosed
WO-2019110464-A1 METHOD FOR PREPARING ETHERS OF CYCLOALIPHATIC OR ARALIPHATIC DIOLS BASF SE (DE) 2019-06-13 WO disclosed
US-20120107701-A1 ELECTROLYTE SOLUTION FOR CHARGEABLE DEVICE, ELECTROLYTE SOLUTION FOR LITHIUM ION SECONDARY BATTERY, AND SECONDARY BATTERY ASAHI GLASS COMPANY, LIMITED (JP) 2012-05-03 US disclosed
US-20070255064-A1 Imidazolium-Methyl Sulfites for Use as Starting Compounds for Producing Ionic Liquids BASF AKTIENGESELLSCHAFT (DE) 2007-11-01 US disclosed
EP-1786780-A1 IMIDAZOLIUM-METHYL SULFITES FOR USE AS STARTING COMPOUNDS FOR PRODUCING IONIC LIQUIDS BASF AKTIENGESELLSCHAFT (DE) 2007-05-23 EP disclosed
WO-2006021303-A1 IMIDAZOLIUM-METHYL SULFITES FOR USE AS STARTING COMPOUNDS FOR PRODUCING IONIC LIQUIDS BASF AKTIENGESELLSCHAFT (DE) 2006-03-02 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 (3 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-20210171427-A1 METHOD FOR PREPARING ETHERS OF CYCLOALIPHATIC OR ARALIPHATIC DIOLS DGKI, MGLL, DEGS1 ALDH1A1 1489/4885TSHR 2908/4885MEN1 876/4885
US-11078146-B2 Method for preparing ethers of cycloaliphatic or araliphatic diols DGKI, MGLL, DEGS1 ALDH1A1 1489/4885TSHR 2908/4885MEN1 876/4885
US-20070255064-A1 Imidazolium-Methyl Sulfites for Use as Starting Compounds for Producing Ionic Liquids CBR3, SCO2, PRMT5 ALDH1A1 3791/4885TSHR 2749/4885MEN1 2137/4885

“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.