SCHEMBL5679908

SCHEMBL5679908

CC(=O)Cc1cccc2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.53
ALDH1A1 P00352 5/20 0.50
MAPT P10636 5/20 0.50
MAPK1 P28482 4/20 0.50
L3MBTL1 Q9Y468 3/20 0.50
EGFR P00533 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
LMNA P02545 2/20 0.50
NSD2 O96028 1/20 0.50
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
PABPC1 P11940 2/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
RAB9A P51151 1/20 0.46
ADORA2A P29274 1/20 0.46
KEAP1 Q14145 3/20 0.45
ELANE P08246 2/20 0.45
NFE2L2 Q16236 1/20 0.45
POLB P06746 2/20 0.43
BCL2 P10415 2/20 0.43

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
SCHEMBL27876964 0.88 MAPT (0.51) MAOAALDH1A1MAPTMAPK1L3MBTL1
SCHEMBL11102725 0.84 ALDH1A1 (0.56) MAOAALDH1A1MAPTMAPK1L3MBTL1
SCHEMBL11814014 0.83 KEAP1 (0.53) MAOAALDH1A1MAPTMAPK1L3MBTL1
SCHEMBL11814983 0.82 L3MBTL1 (0.50) MAOAALDH1A1MAPTMAPK1L3MBTL1
SCHEMBL27562547 0.80 L3MBTL1 (0.45) ALDH1A1MAPTL3MBTL1TDP1LMNA
SCHEMBL11820694 0.80 MEN1 (0.46) MAOAALDH1A1MAPTMAPK1L3MBTL1
SCHEMBL83136 0.80 ADORA2A (0.53) MAOAALDH1A1MAPTMAPK1L3MBTL1
SCHEMBL13343877 0.79 TTR (0.55) ALDH1A1MAPTMAPK1L3MBTL1TDP1
SCHEMBL23723961 0.79 MAOA (0.49) MAOAALDH1A1MAPTMAPK1L3MBTL1
SCHEMBL10686141 0.79 ALDH1A1 (0.50) MAOAALDH1A1MAPTMAPK1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1423470-B1 ARTICLES CONTAINING THIOXANTHONE DYES 3M INNOVATIVE PROPERTIES CO (US) 2006-03-15 EP disclosed
US-6841236-B2 Articles containing thioxanthone dyes 3M INNOVATIVE PROPERTIES CO. (US) 2005-01-11 US disclosed
EP-1423470-A2 ARTICLES CONTAINING THIOXANTHONE DYES 3M Innovative Properties Company (US) 2004-06-02 EP disclosed
US-6713636-B2 HAVING UTILITY AS FLUORESCENT DYES 3M INNOVATIVE PROPERTIES COMPANY 2004-03-30 US disclosed
US-20030077451-A1 Articles containing thioxanthone dyes 3M INNOVATIVE PROPERTIES COMPANY 2003-04-24 US disclosed
US-20030061671-A1 Thioxanthone dyes with improved solubility and a method of preparing 2-oxybenzanthrones as intermediate materials for making of these dyes 3M INNOVATIVE PROPERTIES COMPANY 2003-04-03 US disclosed
WO-2003016407-A1 THIOXANTHONE DYES WITH IMPROVED SOLUBILITY AND A METHOD OF PREPARING 2-OXYBENZANTHRONES AS INTERMEDIATE MATERIALS FOR MAKING OF THESE DYES 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-02-27 WO disclosed
WO-2003016391-A2 ARTICLES CONTAINING THIOXANTHONE DYES 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-02-27 WO disclosed
US-4036859-A Method for the preparation of 2-hydroxybenzanthrone compounds MONTEDISON FIBRE S.P.A. (IT) 1977-07-19 US disclosed
US-4001150-A Composition for preparing electroconductive resin comprising an unsaturated polyester and phosphoric or sulfonic unsaturated ester KANSAI PAINT COMPANY, LTD. (JA) 1977-01-04 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-20030061671-A1 Thioxanthone dyes with improved solubility and a method of preparing 2-oxybenzanthrones as intermediate materials for making of these dyes TH, PPOX, TST MAOA 234/4885ALDH1A1 560/4885MAPT 2066/4885

“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.