SCHEMBL615985

SCHEMBL615985

CCCCO[C](COCC)OCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
ATM Q13315 1/20 0.39
TSHR P16473 6/20 0.38
HPGD P15428 1/20 0.36
CA12 O43570 3/20 0.34
CA1 P00915 3/20 0.34
CA2 P00918 3/20 0.34
CA9 Q16790 3/20 0.34
HCAR2 Q8TDS4 1/20 0.34
ESR1 P03372 2/20 0.33
NAAA Q02083 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CES2 O00748 1/20 0.32
ADRB2 P07550 1/20 0.32
ADRB1 P08588 1/20 0.32
ADRB3 P13945 1/20 0.32
HSD17B10 Q99714 1/20 0.32
LMNA P02545 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL582637 0.96 ALDH1A1 (0.44) ALDH1A1ATMTSHRHPGDCA12
SCHEMBL11513424 0.92 NAAA (0.44) ALDH1A1TSHRCA12CA1CA2
SCHEMBL10766507 0.86 ALDH1A1 (0.35) ALDH1A1TSHRHCAR2HSD17B10
SCHEMBL537764 0.84 TSHR (0.48) ALDH1A1ATMTSHRHPGDCA12
SCHEMBL7150623 0.83 NAAA (0.44) TSHRCA12CA1CA2CA9
SCHEMBL618027 0.83 ALDH1A1 (0.38) ALDH1A1TSHRCA12CA1CA2
SCHEMBL11255576 0.77 HSD17B10 (0.37) ALDH1A1TSHRCA12CA1CA2
SCHEMBL28901350 0.76 TSHR (0.50) ALDH1A1ATMTSHRHPGDCES2
SCHEMBL445923 0.74 ALDH1A1 (0.52) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL5746753 0.74 ALDH1A1 (0.41) ALDH1A1ATMTSHRHPGDCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120037860-A1 DYE-CONTAINING NEGATIVE CURABLE COMPOSITION, COLOR FILTER AND METHOD FOR PRODUCING THE SAME FUJIFILM CORPORATION (JP) 2012-02-16 US disclosed
US-8057969-B2 Dye-containing negative curable composition, color filter and method for producing the same FUJIFILM CORPORATION (JP) 2011-11-15 US disclosed
US-7914956-B2 Dye-containing negative working curable composition, color filter and production method thereof FUJIFILM CORPORATION (JP) 2011-03-29 US disclosed
US-7910272-B2 Dye-containing photosensitive composition, color filter using the same, and production method thereof FUJIFILM CORPORATION (JP) 2011-03-22 US disclosed
US-7645545-B2 Colorant-containing curable composition, color filter and production method thereof FUJIFILM CORPORATION (JP) 2010-01-12 US disclosed
US-20090306376-A1 OPTICAL RECORDING MEDIUM AND COMPOUND USED FOR THE SAME MITSUI CHEMICALS, INC. (JP) 2009-12-10 US disclosed
US-20090273741-A1 OPTICAL MATERIAL HAVING A COLORED OPTICALLY ANISOTROPIC LAYER FUJIFILM CORPORATION (JP) 2009-11-05 US disclosed
EP-2113807-A2 Optical material having a colored optically anisotropic layer Fujifilm Corporation (JP) 2009-11-04 EP disclosed
US-7575837-B2 Colored curable composition, color filter and method for producing the same FUJIFILM CORPORATION (JP) 2009-08-18 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-1245571-A1 BENZBISAZOLE COMPOUND AND OPTICAL RECORDING MEDIUM CONTAINING THE COMPOUND Mitsui Chemicals, Inc. (JP) 2002-10-02 EP disclosed
EP-1180765-A1 Optical recording medium and porphycene compound Mitsui Chemicals, Inc. (JP) 2002-02-20 EP disclosed
EP-0755052-B1 Optical recording medium MITSUI CHEMICALS INC (JP) 1999-11-17 EP disclosed
EP-0755052-A2 Optical recording medium MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1997-01-22 EP disclosed
EP-0254078-B1 PYRAN DERIVATIVES BASF Aktiengesellschaft (DE) 1991-02-06 EP disclosed
EP-0254078-A1 Pyran derivatives BASF Aktiengesellschaft (DE) 1988-01-27 EP disclosed
US-4536209-A N-(3-substituted oxyphenyl)tetrahydrophthalimides and herbicidal composition MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) 1985-08-20 US disclosed
US-4398913-A ALKALINE PASTES CASSELLA AKTIENGESELLSCHAFT (DE) 1983-08-16 US disclosed
EP-0051818-A1 Process for the production of discharge-resist prints on textile materials CASSELLA Aktiengesellschaft (DE) 1982-05-19 EP disclosed
EP-0049508-A1 N-(3-Substituted oxyphenyl) tetrahydrophthalimides and herbicidal composition MITSUBISHI KASEI CORPORATION (JP) 1982-04-14 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 4231/4885ATM 3881/4885TSHR 3610/4885

“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.