SCHEMBL4393313

SCHEMBL4393313

[CH2]COC(=O)OCCOCC

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.56
TSHR P16473 4/20 0.56
THRB P10828 2/20 0.53
SOAT1 P35610 1/20 0.36
HSD17B10 Q99714 4/20 0.35
TP53 P04637 2/20 0.35
HIF1A Q16665 2/20 0.35
EPHX2 P34913 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.32
ALOX15 P16050 1/20 0.31
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31

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
SCHEMBL938633 0.89 ALDH1A1 (0.68) ALDH1A1TSHRTHRBSOAT1HSD17B10
SCHEMBL7456535 0.87 ALDH1A1 (0.56) ALDH1A1TSHRTHRBSOAT1HSD17B10
SCHEMBL1470310 0.86 ALDH1A1 (0.65) ALDH1A1TSHRTHRBSOAT1HSD17B10
SCHEMBL1469713 0.86 ALDH1A1 (0.65) ALDH1A1TSHRTHRBSOAT1HSD17B10
SCHEMBL1470280 0.86 ALDH1A1 (0.65) ALDH1A1TSHRTHRBSOAT1HSD17B10
SCHEMBL1470175 0.86 ALDH1A1 (0.65) ALDH1A1TSHRTHRBSOAT1HSD17B10
SCHEMBL1469988 0.86 ALDH1A1 (0.65) ALDH1A1TSHRTHRBSOAT1HSD17B10
SCHEMBL11416400 0.86 ALDH1A1 (0.65) ALDH1A1TSHRTHRBSOAT1HSD17B10
SCHEMBL9298727 0.85 ALDH1A1 (0.39) ALDH1A1TSHRTHRBSOAT1HSD17B10
SCHEMBL1230517 0.84 ALDH1A1 (0.65) ALDH1A1TSHRTHRBSOAT1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5312926-A Paper, videos or paper BASF AKTIENGESELLSCHAFT (DE) 1994-05-17 US claimed
US-5283326-A Coupling azo and cyanine dyes; colorfastness, heat resistance SANDOZ AG (CH) 1994-02-01 US claimed
US-4837269-A FIBER-REACTIVE DISAZO DYES BASF AKTIENGESELLSCHAFT (DE) 1989-06-06 US claimed
US-4751288-A COLORFASTNESS BASF AKTIENGESELLSCHAFT (DE) 1988-06-14 US claimed
US-4619992-A IMPROVED COLORFASTNESS BASF AKTIENGESELLSCHAFT (DE) 1986-10-28 US claimed
EP-0196537-A2 Water insoluble red monoazo dyes, their preparation and their use CASSELLA Aktiengesellschaft (DE) 1986-10-08 EP claimed
US-4496480-A Isothiazolazo dyes having coupling components which are free from unsaturated aliphatic radicals BASF AKTIENGESELLSCHAFT (DE) 1985-01-29 US claimed
US-20090306376-A1 OPTICAL RECORDING MEDIUM AND COMPOUND USED FOR THE SAME MITSUI CHEMICALS, INC. (JP) 2009-12-10 US disclosed
US-7405030-B2 Imide compound and optical recording media made by using the same MITSUI CHEMICALS, INC. (JP) 2008-07-29 US disclosed
EP-1930339-A2 Imide compound MITSUI CHEMICALS, INC. (JP) 2008-06-11 EP disclosed
US-20070259151-A1 Imide compound and optical recording media made by using the same MITSUI CHEMICALS, INC. (JP) 2007-11-08 US disclosed
US-7259260-B2 Imide compound and optical recording media made by using the same MITSUI CHEMICALS, INC. (JP) 2007-08-21 US disclosed
US-20070054084-A1 Optical recording medium and compound used for the same MITSUI CHEMICALS, INC. (JP) 2007-03-08 US disclosed
EP-0170157-A2 Methine dyes BASF Aktiengesellschaft (DE) 1986-02-05 EP disclosed
EP-0169483-A2 Heterocyclic azo dyes BASF Aktiengesellschaft (DE) 1986-01-29 EP disclosed
EP-0156216-A1 Isothiazole azo dyestuffs BASF Aktiengesellschaft (DE) 1985-10-02 EP disclosed
US-4496480-A Isothiazolazo dyes having coupling components which are free from unsaturated aliphatic radicals BASF AKTIENGESELLSCHAFT (DE) 1985-01-29 US disclosed
EP-0131757-A1 Disazo dyestuffs of the isothiazole series BASF Aktiengesellschaft (DE) 1985-01-23 EP disclosed
EP-0131314-A1 Reactive monoazo dyestuffs MITSUBISHI KASEI CORPORATION (JP) 1985-01-16 EP disclosed
EP-0087677-A1 Isothiazolazo dyestuffs BASF Aktiengesellschaft (DE) 1983-09-07 EP 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-20090306376-A1 OPTICAL RECORDING MEDIUM AND COMPOUND USED FOR THE SAME CACNA1B, KCNN4, KCNN2 ALDH1A1 4231/4885TSHR 3610/4885THRB 3053/4885

“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.