SCHEMBL12216663

SCHEMBL12216663

CC(/C=C/C1=C(O)OC2(CCCCC2)OC1=O)=C\C=C1C(=O)OC2(CCC3(CC2)OC(=O)C(/C=C/C(C)=C/C=C2C(=O)OC4(CCCCC4)OC2=O)=C(O)O3)OC1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 13/20 0.37
▸ KDM4E B2RXH2 3/20 0.37
▸ NPSR1 Q6W5P4 6/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ LMNA P02545 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ CRHBP P24387 2/20 0.33
▸ CRHR2 Q13324 2/20 0.33
▸ PKM P14618 2/20 0.33
▸ HPGD P15428 4/20 0.32
▸ HTT P42858 1/20 0.31
▸ PTPN1 P18031 1/20 0.30
▸ ACP1 P24666 1/20 0.30
▸ CDC25B P30305 1/20 0.30
▸ L3MBTL1 Q9Y468 2/20 0.30
▸ CASP1 P29466 1/20 0.30
▸ CASP7 P55210 1/20 0.30

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
SCHEMBL14442045 0.93 KDM4E (0.32) ALDH1A1KDM4E
SCHEMBL12715229 0.86 — —
SCHEMBL12715227 0.85 — —
SCHEMBL12715202 0.84 — —
SCHEMBL12715235 0.80 — —
SCHEMBL12216526 0.80 ALDH1A1 (0.37) ALDH1A1KDM4ENPSR1CYP1A2CYP3A4
SCHEMBL12216666 0.80 — —
SCHEMBL12744382 0.80 KDM4E (0.30) ALDH1A1KDM4E
SCHEMBL12715212 0.79 ALDH1A1 (0.35) ALDH1A1KDM4ENPSR1CYP1A2CYP3A4
SCHEMBL12715127 0.79 ALDH1A1 (0.35) ALDH1A1KDM4ENPSR1CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8039630-B2 Cationic compound, dye compound and method of using the same, and optical information recording medium FUJIFILM CORPORATION (JP) 2011-10-18 — — US disclosed
US-8039630-B2 Cationic compound, dye compound and method of using the same, and optical information recording medium FUJIFILM CORPORATION (JP) 2011-10-18 — — US disclosed
US-7924697-B2 Optical information recording medium, image-recording method and method of utilizing a dye FUJIFILM CORPORATION (JP) 2011-04-12 — — US disclosed
US-7924697-B2 Optical information recording medium, image-recording method and method of utilizing a dye FUJIFILM CORPORATION (JP) 2011-04-12 — — US disclosed
US-20090130367-A1 CATIONIC COMPOUND, DYE COMPOUND AND METHOD OF USING THE SAME, AND OPTICAL INFORMATION RECORDING MEDIUM FUJIFILM CORPORATION (JP) 2009-05-21 — — US disclosed
US-20090130367-A1 CATIONIC COMPOUND, DYE COMPOUND AND METHOD OF USING THE SAME, AND OPTICAL INFORMATION RECORDING MEDIUM FUJIFILM CORPORATION (JP) 2009-05-21 — — US disclosed
US-20090092024-A1 OPTICAL INFORMATION RECORDING MEDIUM, IMAGE-RECORDING METHOD AND METHOD OF UTILIZING A DYE FUJIFILM CORPORATION (JP) 2009-04-09 — — US disclosed
US-20090092024-A1 OPTICAL INFORMATION RECORDING MEDIUM, IMAGE-RECORDING METHOD AND METHOD OF UTILIZING A DYE FUJIFILM CORPORATION (JP) 2009-04-09 — — US disclosed
US-20090082570-A1 METHOD OF MANUFACTURING BIPYRIDINIUM COMPOUND AND SYNTHETIC INTERMEDIATE OF THE SAME, METHOD OF MANUFACTURING DYE COMPOUND, AND NOVEL BIPYRIDINIUM COMPOUND AND NOVEL DYE COMPOUND COMPRISING THE SAME FUJIFILM CORPORATION (JP) 2009-03-26 — — US disclosed
US-20090082570-A1 METHOD OF MANUFACTURING BIPYRIDINIUM COMPOUND AND SYNTHETIC INTERMEDIATE OF THE SAME, METHOD OF MANUFACTURING DYE COMPOUND, AND NOVEL BIPYRIDINIUM COMPOUND AND NOVEL DYE COMPOUND COMPRISING THE SAME FUJIFILM CORPORATION (JP) 2009-03-26 — — US disclosed
US-20080274423-A1 OPTICAL INFORMATION RECORDING MEDIUM AND METHOD OF RECORDING INFORMATION FUJIFILM CORPORATION (JP) 2008-11-06 — — US disclosed
US-20080274423-A1 OPTICAL INFORMATION RECORDING MEDIUM AND METHOD OF RECORDING INFORMATION FUJIFILM CORPORATION (JP) 2008-11-06 — — US disclosed
US-20080090174-A1 Novel Oxonol Dye Compounds and Optical Information Recording Medium FUJIFILM CORPORATION (JP) 2008-04-17 — — US disclosed
US-20080090174-A1 Novel Oxonol Dye Compounds and Optical Information Recording Medium FUJIFILM CORPORATION (JP) 2008-04-17 — — US disclosed
US-7238461-B2 Optical information-recording medium, novel oxonol compound and method of recording information FUJIFILM CORPORATION (JP) 2007-07-03 — — US disclosed
US-7238461-B2 Optical information-recording medium, novel oxonol compound and method of recording information FUJIFILM CORPORATION (JP) 2007-07-03 — — US disclosed
US-20070020562-A1 Optical information-recording medium, novel oxonol compound and method of recording information FUJI PHOTO FILM CO., LTD. 2007-01-25 — — US disclosed
US-20070020562-A1 Optical information-recording medium, novel oxonol compound and method of recording information FUJI PHOTO FILM CO., LTD. 2007-01-25 — — 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 (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-20090082570-A1 METHOD OF MANUFACTURING BIPYRIDINIUM COMPOUND AND SYNTHETIC INTERMEDIATE OF THE SAME, METHOD OF MANUFACTURING DYE COMPOUND, AND NOVEL BIPYRIDINIUM COMPOUND AND NOVEL DYE COMPOUND COMPRISING THE SAME RRS1, RPS3, ADRM1 ALDH1A1 1072/4885KDM4E 3922/4885NPSR1 873/4885
US-20080090174-A1 Novel Oxonol Dye Compounds and Optical Information Recording Medium KCNB1, KCNMB1, HCN2 ALDH1A1 445/4885KDM4E 3134/4885NPSR1 663/4885
US-20090130367-A1 CATIONIC COMPOUND, DYE COMPOUND AND METHOD OF USING THE SAME, AND OPTICAL INFORMATION RECORDING MEDIUM CHRM1, CHRM2, TRPC6 ALDH1A1 1010/4885KDM4E 4329/4885NPSR1 835/4885

“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.

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