SCHEMBL12216645

SCHEMBL12216645

O=C1C(=CC=CC=Cc2c(O)n(-c3ccccc3)n(-c3ccccc3)c2=O)C(=O)N(c2ccccc2)N1c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.38
▸ KMT2A Q03164 11/20 0.36
▸ MEN1 O00255 7/20 0.36
▸ MAPT P10636 7/20 0.35
▸ POLB P06746 5/20 0.35
▸ CACNA1B Q00975 1/20 0.35
▸ APBA1 Q02410 1/20 0.35
▸ USP2 O75604 1/20 0.34
▸ KDM4E B2RXH2 3/20 0.33
▸ HPGD P15428 1/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ CASP7 P55210 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ MAPK1 P28482 4/20 0.33
▸ PKM P14618 2/20 0.33
▸ HTT P42858 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ OPRK1 P41145 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ MMP14 P50281 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
SCHEMBL12715299 1.00 ALDH1A1 (0.38) ALDH1A1KMT2AMEN1MAPTPOLB
SCHEMBL13019509 0.95 ALDH1A1 (0.39) ALDH1A1KMT2AMEN1MAPTPOLB
SCHEMBL13943140 0.83 KMT2A (0.37) ALDH1A1KMT2AMEN1MAPTPOLB
SCHEMBL13942892 0.81 ALDH1A1 (0.38) ALDH1A1KMT2AMEN1MAPTPOLB
SCHEMBL12511897 0.81 MAPT (0.47) ALDH1A1KMT2AMEN1MAPTKDM4E
SCHEMBL12216648 0.74 ALDH1A1 (0.40) ALDH1A1KMT2AMEN1MAPTCASP1
SCHEMBL13019514 0.70 MAPT (0.49) ALDH1A1KMT2AMEN1MAPTPOLB
SCHEMBL13172319 0.70 MAPT (0.49) ALDH1A1KMT2AMEN1MAPTPOLB
SCHEMBL13966824 0.70 ALDH1A1 (0.49) ALDH1A1KMT2AMEN1MAPTKDM4E
SCHEMBL13890918 0.66 ALDH1A1 (0.34) ALDH1A1KMT2AMEN1MAPTGAA

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 6 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-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-20090029093-A1 OPTICAL INFORMATION RECORDING MEDIUM AND PROCESS FOR PRODUCING THE SAME FUJIFILM CORPORATION (JP) 2009-01-29 — — US disclosed
US-20080165668-A1 RECORDING MEDIUM AND INFORMATION RECORDING AND REPRODUCING METHOD USING THE SAME FUJIFILM CORPORATION 2008-07-10 — — US disclosed
US-20080165668-A1 RECORDING MEDIUM AND INFORMATION RECORDING AND REPRODUCING METHOD USING THE SAME FUJIFILM CORPORATION 2008-07-10 — — 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 (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-20090130367-A1 CATIONIC COMPOUND, DYE COMPOUND AND METHOD OF USING THE SAME, AND OPTICAL INFORMATION RECORDING MEDIUM CHRM1, CHRM2, TRPC6 ALDH1A1 1010/4885KMT2A 2727/4885MEN1 161/4885

“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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