SCHEMBL2483117

SCHEMBL2483117

Cn1c(=O)cc2c3c(c(Br)ccc31)C(=O)c1ccccc1-2

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 2/20 0.71
▸ ADORA2A P29274 1/20 0.71
▸ MEN1 O00255 10/20 0.62
▸ KMT2A Q03164 10/20 0.62
▸ MAPT P10636 9/20 0.62
▸ POLB P06746 6/20 0.62
▸ L3MBTL1 Q9Y468 5/20 0.62
▸ MAPK1 P28482 4/20 0.62
▸ THRB P10828 3/20 0.62
▸ S100A4 P26447 2/20 0.62
▸ NSD2 O96028 1/20 0.62
▸ TDP1 Q9NUW8 1/20 0.62
▸ USP2 O75604 5/20 0.60
▸ ALDH1A1 P00352 4/20 0.60
▸ KDM4E B2RXH2 3/20 0.60
▸ KEAP1 Q14145 1/20 0.60
▸ NFE2L2 Q16236 1/20 0.60
▸ NR4A1 P22736 1/20 0.59
▸ PABPC1 P11940 2/20 0.56
▸ SMN1; SMN2 Q16637 3/20 0.55

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
SCHEMBL2481237 0.83 ADORA2A (1.00) CYP1A2ADORA2AMEN1KMT2AMAPT
SCHEMBL13295898 0.81 CYP1A2 (0.67) CYP1A2ADORA2AMEN1KMT2AMAPT
SCHEMBL12311502 0.78 NR4A1 (0.79) CYP1A2ADORA2AMEN1KMT2AMAPT
SCHEMBL14422840 0.77 MAPT (1.00) CYP1A2ADORA2AMEN1KMT2AMAPT
SCHEMBL13856162 0.75 NR4A1 (1.00) CYP1A2ADORA2AMEN1KMT2AMAPT
SCHEMBL12311433 0.75 CYP1A2 (0.59) CYP1A2ADORA2AMEN1KMT2AMAPT
SCHEMBL12311501 0.75 NR4A1 (0.71) CYP1A2ADORA2AMEN1KMT2AMAPT
SCHEMBL12311514 0.75 NR4A1 (0.65) CYP1A2ADORA2AMEN1KMT2AMAPT
SCHEMBL29384913 0.75 NR4A1 (0.78) CYP1A2ADORA2AMEN1KMT2AMAPT
SCHEMBL305199 0.75 NR4A1 (0.78) CYP1A2ADORA2AMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2057123-B1 ANTHRAPYRIDONE COMPOUNDS SABIC INNOVATIVE PLASTICS IP (NL) 2011-10-19 — — EP disclosed
US-7812076-B2 Anthrapyridone compounds SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2010-10-12 — — US disclosed
EP-2057123-A1 ANTHRAPYRIDONE COMPOUNDS Sabic Innovative Plastics IP B.V. (NL) 2009-05-13 — — EP disclosed
US-20080045634-A1 ANTHRAPYRIDONE COMPOUNDS GENERAL ELECTRIC COMPANY (US) 2008-02-21 — — US disclosed
WO-2008021694-A1 ANTHRAPYRIDONE COMPOUNDS SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2008-02-21 — — WO disclosed
EP-1546263-B1 ACID RED 82 IN MIXTURES LANXESS DEUTSCHLAND GMBH (DE) 2007-10-03 — — EP disclosed
EP-1546263-B1 ACID RED 82 IN MIXTURES LANXESS DEUTSCHLAND GMBH (DE) 2007-10-03 — — EP disclosed
US-7193085-B2 Acid Red 82 in mixtures LANXESS DEUTSCHLAND GMBH (DE) 2007-03-20 — — US disclosed
US-7193085-B2 Acid Red 82 in mixtures LANXESS DEUTSCHLAND GMBH (DE) 2007-03-20 — — US disclosed
US-7193085-B2 Acid Red 82 in mixtures LANXESS DEUTSCHLAND GMBH (DE) 2007-03-20 — — US disclosed
US-20060144289-A1 Acid red 82 in mixtures LANXESS DEUTSCHLAND GMBH (DE) 2006-07-06 — — US disclosed
EP-1546263-A1 ACID RED 82 IN MIXTURES Lanxess Deutschland GmbH (DE) 2005-06-29 — — EP disclosed
WO-2004031301-A1 ACID RED 82 IN MIXTURES LANXESS DEUTSCHLAND GMBH (DE) 2004-04-15 — — 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 (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-20060144289-A1 Acid red 82 in mixtures IK, CD74, ALDH1A2 CYP1A2 39/4885ADORA2A 1863/4885MEN1 1723/4885

“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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