SCHEMBL2229401

SCHEMBL2229401

Nc1cccc2c(=O)n(O)[nH]c(=O)c12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.53
▸ PARP1 P09874 9/20 0.40
▸ TDP1 Q9NUW8 4/20 0.40
▸ RECQL P46063 2/20 0.40
▸ JAK2 O60674 1/20 0.39
▸ RPS6KA3 P51812 1/20 0.39
▸ MELK Q14680 1/20 0.39
▸ STK24 Q9Y6E0 1/20 0.39
▸ CA1 P00915 2/20 0.36
▸ CA2 P00918 2/20 0.36
▸ ACHE P22303 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ USP2 O75604 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ ATM Q13315 1/20 0.36
▸ KEAP1 Q14145 1/20 0.36
▸ NFE2L2 Q16236 1/20 0.36
▸ TYMS P04818 1/20 0.36
▸ CYP3A4 P08684 2/20 0.35
▸ HPGD P15428 1/20 0.35

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
SCHEMBL2229693 0.79 KDM4E (0.58) ALDH1A1PARP1TDP1RECQLJAK2
SCHEMBL2229176 0.79 ALDH1A1 (0.53) ALDH1A1PARP1TDP1RECQLJAK2
SCHEMBL2229183 0.79 ALDH1A1 (0.53) ALDH1A1PARP1TDP1RECQLJAK2
SCHEMBL2228710 0.79 ALDH1A1 (0.53) ALDH1A1PARP1TDP1RECQLJAK2
SCHEMBL2231071 0.79 ALDH1A1 (0.53) ALDH1A1PARP1TDP1RECQLJAK2
SCHEMBL2353924 0.79 ALDH1A1 (0.49) ALDH1A1PARP1TDP1RECQLJAK2
SCHEMBL16596114 0.78 ALDH1A1 (0.51) ALDH1A1PARP1TDP1RECQLJAK2
SCHEMBL2228793 0.78 ALDH1A1 (0.47) ALDH1A1PARP1TDP1RECQLJAK2
SCHEMBL2231860 0.77 ALDH1A1 (0.50) ALDH1A1PARP1TDP1RECQLJAK2
SCHEMBL2229404 0.76 ALDH1A1 (0.49) ALDH1A1PARP1TDP1RECQLJAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140030317-A1 MODULATION OF CELL FATES AND ACTIVITIES BY PHTHALAZINEDIONES Occhiuti & Rohlicek LLP 2014-01-30 — — US claimed
EP-2398325-A1 METHODS OF TREATING INTESTINAL DISEASES AND INFLAMMATORY CONDITIONS RELATED TO HIV-AIDS Bach Pharma, Inc. (US) 2011-12-28 — — EP claimed
EP-2346522-A1 METHODS OF MODULATING PROTEIN HOMEOSTASIS, METABOLIC SYNDROME, HEAVY METAL INTOXICATION AND NRF2 TRANSCRIPTION FACTORS Bach Pharma, Inc. (US) 2011-07-27 — — EP claimed
US-20100255077-A1 METHODS OF TREATING INTESTINAL DISEASES AND INFLAMMATORY CONDITIONS RELATED TO HIV-AIDS BACH PHARMA, INC. (US) 2010-10-07 — — US claimed
WO-2010096686-A1 METHODS OF TREATING INTESTINAL DISEASES AND INFLAMMATORY CONDITIONS RELATED TO HIV-AIDS BACH PHARMA, INC. (US) 2010-08-26 — — WO claimed
US-20100086531-A1 METHODS OF MODULATING PROTEIN HOMEOSTASIS, METABOLIC SYNDROME, HEAVY METAL INTOXICATION AND Nrf2 TRANSCRIPTION FACTORS BACH PHARMA INC. (US) 2010-04-08 — — US claimed
US-7691819-B2 Modulation of cell fates and activities by phthalazinediones BACH PHARMA, INC. (US) 2010-04-06 — — US claimed
WO-2010036711-A1 METHODS OF MODULATING PROTEIN HOMEOSTASIS, METABOLIC SYNDROME, HEAVY METAL INTOXICATION AND NRF2 TRANSCRIPTION FACTORS BACH PHARMA INC. (US) 2010-04-01 — — WO claimed
US-20090036411-A1 MODULATION OF CELL FATES AND ACTIVITIES BY PHTHALAZINEDIONES BACH PHARMA, INC. (US) 2009-02-05 — — US claimed
EP-1924274-A4 MODULATION OF CELL FATES AND ACTIVITIES BY PHTHALAZINEDIONES BACH PHARMA INC (US) 2008-10-08 — — EP claimed
EP-1924274-A1 MODULATION OF CELL FATES AND ACTIVITIES BY PHTHALAZINEDIONES Bach Pharma, Inc (US) 2008-05-28 — — EP claimed
US-7326690-B2 Modulation of cell fates and activities by phthalazinediones BACH PHARMA, INC. (US) 2008-02-05 — — US claimed
US-20070142303-A1 Modulation of cell fates and activities by phthalazinediones BACH PHARMA, INC. (US) 2007-06-21 — — US claimed
WO-2007018546-A1 MODULATION OF CELL FATES AND ACTIVITIES BY PHTHALAZINEDIONES BACH PHARMA, INC. (US) 2007-02-15 — — WO claimed
US-20050288291-A1 Modulation of cell fates and activities by phthalazinediones BACH PHARMA, INC. (US) 2005-12-29 — — US claimed
US-12246068-B2 Enzymatically activatable peptide-redox modulator conjugates and use thereof BRANDEIS UNIVERSITY (US) 2025-03-11 — — US disclosed
US-20210161890-A1 COMPOSITIONS AND METHODS FOR TREATING BRAIN DYSFUNCTION BACH PHARMA, INC. 2021-06-03 — — US disclosed
US-20070142303-A1 Modulation of cell fates and activities by phthalazinediones BACH PHARMA, INC. (US) 2007-06-21 — — US disclosed
WO-2007018546-A1 MODULATION OF CELL FATES AND ACTIVITIES BY PHTHALAZINEDIONES BACH PHARMA, INC. (US) 2007-02-15 — — WO disclosed
US-20050288291-A1 Modulation of cell fates and activities by phthalazinediones BACH PHARMA, INC. (US) 2005-12-29 — — 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 (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-20210161890-A1 COMPOSITIONS AND METHODS FOR TREATING BRAIN DYSFUNCTION GRIK5, PMP22, GRIN2A ALDH1A1 1868/4885PARP1 2018/4885TDP1 1437/4885
US-12246068-B2 Enzymatically activatable peptide-redox modulator conjugates and use thereof GPX1, GPX4, ENPEP ALDH1A1 777/4885PARP1 3212/4885TDP1 2630/4885

“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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