SCHEMBL1803435

SCHEMBL1803435

Cc1ccc(C(=O)O)cc1[NH]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 4/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ MYC P01106 1/20 0.47
▸ ESR1 P03372 1/20 0.47
▸ ALOX15 P16050 1/20 0.47
▸ PTPN7 P35236 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ TP53 P04637 1/20 0.46
▸ GRM1 Q13255 2/20 0.46
▸ TDP1 Q9NUW8 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ GAA P10253 2/20 0.45
▸ CA12 O43570 2/20 0.45
▸ CA1 P00915 2/20 0.45
▸ CA2 P00918 2/20 0.45
▸ CA4 P22748 2/20 0.45
▸ CA6 P23280 2/20 0.45

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
SCHEMBL1805221 0.83 TSHR (0.52) TSHRSMN1; SMN2ALDH1A1MYCESR1
SCHEMBL1804065 0.81 PARP1 (0.48) TSHRSMN1; SMN2ALDH1A1HSD17B10TDP1
SCHEMBL310259 0.79 CES2 (0.63) TSHRSMN1; SMN2ALDH1A1MYCESR1
SCHEMBL29421064 0.79 CES2 (0.63) TSHRSMN1; SMN2ALDH1A1MYCESR1
SCHEMBL6917731 0.77 CES2 (0.61) TSHRSMN1; SMN2ALDH1A1MYCESR1
Bromide SCHEMBL6113088 0.77 CES2 (0.61) TSHRSMN1; SMN2ALDH1A1MYCESR1
SCHEMBL6914769 0.77 CES2 (0.61) TSHRSMN1; SMN2ALDH1A1MYCESR1
Iodide SCHEMBL6113500 0.77 CES2 (0.61) TSHRSMN1; SMN2ALDH1A1MYCESR1
SCHEMBL6912740 0.77 CES2 (0.61) TSHRSMN1; SMN2ALDH1A1MYCESR1
SCHEMBL6913463 0.77 CES2 (0.61) TSHRSMN1; SMN2ALDH1A1MYCESR1

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
EP-3421548-B1 COLORING COMPOSITION, INKJET RECORDING INK, INKJET RECORDING METHOD, AND INKJET PRINTER CARTRIDGE FUJIFILM CORP (JP) 2024-01-24 — — EP disclosed
CN-108699349-B Coloring composition, ink for inkjet recording, inkjet recording method, and ink cartridge for inkjet printer 富士胶片株式会社 2021-03-12 — — CN disclosed
US-10689535-B2 Coloring composition, ink jet recording ink, ink jet recording method, and ink jet printer cartridge FUJIFILM CORPORATION (JP) 2020-06-23 — — US disclosed
EP-2799498-B1 COMPOUND HAVING XANTHENE SKELETON, COLORING COMPOSITION, INK FOR INK JET PRINTING, AND INK JET PRINTING METHOD FUJIFILM CORP (JP) 2019-05-01 — — EP disclosed
EP-3421548-A1 COLORING COMPOSITION, INKJET RECORDING INK, INKJET RECORDING METHOD, AND INKJET PRINTER CARTRIDGE FUJIFILM Corporation (JP) 2019-01-02 — — EP disclosed
US-20180346743-A1 COLORING COMPOSITION, INK JET RECORDING INK, INK JET RECORDING METHOD, AND INK JET PRINTER CARTRIDGE FUJIFILM CORPORATION (JP) 2018-12-06 — — US disclosed
US-9023139-B2 Coloring composition, ink for inkjet recording and inkjet recording method FUJIFILM CORPORATION (JP) 2015-05-05 — — US disclosed
US-9023138-B2 Compound having xanthene skeleton, coloring composition, ink for ink jet recording and ink jet recording method FUJIFILM CORPORATION (JP) 2015-05-05 — — US disclosed
EP-2821444-A1 COLORED COMPOSITION, INKJET RECORDING INK, AND INKJET RECORDING METHOD Fujifilm Corporation (JP) 2015-01-07 — — EP disclosed
US-20140368573-A1 COLORING COMPOSITION, INK FOR INKJET RECORDING AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2014-12-18 — — US disclosed
EP-2799498-A1 COMPOUND HAVING XANTHENE SKELETON, COLORING COMPOSITION, INK FOR INK JET PRINTING, AND INK JET PRINTING METHOD Fujifilm Corporation (JP) 2014-11-05 — — EP disclosed
US-20140305336-A1 COMPOUND HAVING XANTHENE SKELETON, COLORING COMPOSITION, INK FOR INK JET RECORDING AND INK JET RECORDING METHOD FUJIFILM CORPORATION (JP) 2014-10-16 — — US disclosed
US-8404036-B2 Water-soluble near-infrared absorbing coloring matters and aqueous inks containing same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2013-03-26 — — US disclosed
US-20110123784-A1 WATER-SOLUBLE NEAR-INFRARED ABSORBING COLORING MATTERS AND AQUEOUS INKS CONTAINING SAME NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-05-26 — — US disclosed
EP-1626070-B1 NOVEL ANTHRAPYRIDONE COMPOUND, AQUEOUS MAGENTA INK COMPOSITION AND INKJET RECORDING METHOD NIPPON KAYAKU KK (JP) 2010-07-07 — — EP disclosed
US-7297196-B2 Anthrapyridone compound, water-based magenta ink composition and inkjet recording method NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2007-11-20 — — US disclosed
US-20070062413-A1 Novel anthrapyridone compound, water-based magenta ink composition and inkjet recording method NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2007-03-22 — — US disclosed
EP-1626070-A1 NOVEL ANTHRAPYRIDONE COMPOUND, AQUEOUS MAGENTA INK COMPOSITION AND INKJET RECORDING METHOD Nippon Kayaku Kabushiki Kaisha (JP) 2006-02-15 — — 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 (2 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-20070062413-A1 Novel anthrapyridone compound, water-based magenta ink composition and inkjet recording method WNT1, SFRP1, MLLT1 TSHR 4774/4885SMN1; SMN2 4393/4885ALDH1A1 165/4885
US-20110123784-A1 WATER-SOLUBLE NEAR-INFRARED ABSORBING COLORING MATTERS AND AQUEOUS INKS CONTAINING SAME IK, RB1, COL1A1 TSHR 3565/4885SMN1; SMN2 1683/4885ALDH1A1 218/4885

“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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