SCHEMBL7829487

SCHEMBL7829487

NC(=O)c1cccc2c1C(=O)c1ccccc1-2

nearest known ligand 0.73

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.73
NFE2L2 Q16236 1/20 0.73
ALDH1A1 P00352 4/20 0.70
MAPT P10636 2/20 0.70
LMNA P02545 2/20 0.70
L3MBTL1 Q9Y468 1/20 0.59
NPC1 O15118 1/20 0.58
GRK6 P43250 1/20 0.56
GLA P06280 1/20 0.55
HTT P42858 1/20 0.55
POLB P06746 2/20 0.53
BCAT2 O15382 1/20 0.50

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
SCHEMBL7121384 0.92 KEAP1 (0.86) KEAP1NFE2L2ALDH1A1MAPTLMNA
SCHEMBL5866501 0.90 KEAP1 (0.69) KEAP1NFE2L2ALDH1A1MAPTLMNA
SCHEMBL30268664 0.86 KEAP1 (0.70) KEAP1NFE2L2ALDH1A1MAPTLMNA
SCHEMBL3605803 0.86 KEAP1 (0.75) KEAP1NFE2L2ALDH1A1MAPTLMNA
SCHEMBL4930390 0.85 KEAP1 (1.00) KEAP1NFE2L2ALDH1A1MAPTLMNA
SCHEMBL581124 0.82 ALDH1A1 (1.00) ALDH1A1MAPTLMNAL3MBTL1NPC1
SCHEMBL8279098 0.81 ALDH1A1 (0.70) ALDH1A1MAPTLMNAL3MBTL1NPC1
SCHEMBL678363 0.81 ALDH1A1 (0.70) KEAP1NFE2L2ALDH1A1MAPTLMNA
SCHEMBL5729760 0.81 ALDH1A1 (0.70) KEAP1NFE2L2ALDH1A1MAPTLMNA
SCHEMBL6937072 0.79 NPC1 (0.71) KEAP1NFE2L2ALDH1A1MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1066257-A2 HETEROCYLIC CLASSES OF COMPOUNDS FOR THE MODULATING TYROSINE PROTEIN KINASE Sugen, Inc. (US) 2001-01-10 EP claimed
WO-1999048868-A9 HETEROCYCLIC CLASSES OF COMPOUNDS FOR THE MODULATING TYROSINE PROTEIN KINASE SUGEN INC (US) 2000-04-20 WO claimed
WO-1999048868-A2 HETEROCYCLIC CLASSES OF COMPOUNDS FOR THE MODULATING TYROSINE PROTEIN KINASE SUGEN, INC. (US) 1999-09-30 WO claimed
EP-3328832-B1 FUCOSIDASE INHIBITORS HORIZON ORPHAN LLC (US) 2021-03-03 EP disclosed
US-10308607-B2 Fucosidase inhibitors HORIZON ORPHAN LLC (US) 2019-06-04 US disclosed
US-20190077756-A1 FUCOSIDASE INHIBITORS HORIZON ORPHAN LLC (US) 2019-03-14 US disclosed
US-20170029376-A1 FUCOSIDASE INHIBITORS RAPTOR PHARMACEUTICALS INC. (US) 2017-02-02 US disclosed
WO-2017019925-A1 FUCOSIDASE INHIBITORS RAPTOR PHARMACEUTICALS INC. (US) 2017-02-02 WO disclosed
US-20140221455-A1 DIFFERENTIATION MODULATING AGENTS AND USES THEREFOR Verva Pharmaceuticals, Inc. (AU) 2014-08-07 US disclosed
US-8034944-B2 Benzofluoranthene compound and organic light-emitting device using the compound CANON KABUSHIKI KAISHA (JP) 2011-10-11 US disclosed
US-8034944-B2 Benzofluoranthene compound and organic light-emitting device using the compound CANON KABUSHIKI KAISHA (JP) 2011-10-11 US disclosed
US-20090278118-A1 BENZOFLUORANTHENE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE COMPOUND CANON KABUSHIKI KAISHA (JP) 2009-11-12 US disclosed
US-20090278118-A1 BENZOFLUORANTHENE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE COMPOUND CANON KABUSHIKI KAISHA (JP) 2009-11-12 US disclosed
WO-2008078824-A1 BENZOFLUORANTHENE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE COMPOUND CANON KABUSHIKI KAISHA (JP) 2008-07-03 WO disclosed
WO-1999048868-A9 HETEROCYCLIC CLASSES OF COMPOUNDS FOR THE MODULATING TYROSINE PROTEIN KINASE SUGEN INC (US) 2000-04-20 WO 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 (4 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-20170029376-A1 FUCOSIDASE INHIBITORS FUCA1, FUCA2, ENGASE KEAP1 393/4885NFE2L2 2617/4885ALDH1A1 588/4885
US-20190077756-A1 FUCOSIDASE INHIBITORS FUCA1, FUCA2, ENGASE KEAP1 393/4885NFE2L2 2617/4885ALDH1A1 588/4885
US-20090278118-A1 BENZOFLUORANTHENE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE COMPOUND XDH, XPO6, PAX3 KEAP1 2501/4885NFE2L2 135/4885ALDH1A1 1092/4885
US-10308607-B2 Fucosidase inhibitors FUCA1, FUCA2, ENGASE KEAP1 393/4885NFE2L2 2617/4885ALDH1A1 588/4885

“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.