SCHEMBL241952

SCHEMBL241952

[CH2]COc1ccc2ccccc2n1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.56
MAPT P10636 1/20 0.56
KMT2A Q03164 1/20 0.56
CYSLTR1 Q9Y271 2/20 0.44
CYSLTR2 Q9NS75 1/20 0.44
NCF1 P14598 3/20 0.42
NOS2 P35228 1/20 0.42
BACE1 P56817 1/20 0.42
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
CYP1A2 P05177 1/20 0.42
PDE10A Q9Y233 2/20 0.41
HDAC1 Q13547 2/20 0.40
HDAC8 Q9BY41 2/20 0.40
HDAC6 Q9UBN7 2/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL28900531 0.82 MEN1 (0.58) MEN1MAPTKMT2ACYSLTR1CYSLTR2
SCHEMBL28628097 0.80 MEN1 (0.56) MEN1MAPTKMT2ACYSLTR1CYSLTR2
SCHEMBL887723 0.80 MAPT (0.56) MEN1MAPTKMT2ACYSLTR1CYSLTR2
SCHEMBL7697138 0.80 KMT2A (0.56) MEN1MAPTKMT2ACYSLTR1CYSLTR2
SCHEMBL31531064 0.80 MEN1 (0.56) MEN1MAPTKMT2ACYSLTR1CYSLTR2
SCHEMBL1775180 0.79 MAPT (0.51) MEN1MAPTKMT2ACYSLTR1CYSLTR2
SCHEMBL5735971 0.77 MEN1 (0.61) MEN1MAPTKMT2ACYSLTR1CYSLTR2
SCHEMBL9663555 0.77 MAPT (0.61) MEN1MAPTKMT2ACYSLTR1CYSLTR2
SCHEMBL1010648 0.77 MEN1 (0.53) MEN1MAPTKMT2ACYSLTR1CYSLTR2
SCHEMBL30060467 0.77 MEN1 (0.61) MEN1MAPTKMT2ACYSLTR1CYSLTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1833824-B1 3-CYCLOALKYLCARBONYL INDOLES AS CANNABINOID RECEPTOR LIGANDS ABBVIE INC (US) 2016-08-03 EP disclosed
US-8383668-B2 11-beta-hydroxysteroid dehydrogenase type 1 active compounds HIGH POINT PHARMACEUTICALS, LLC (US) 2013-02-26 US disclosed
US-8383683-B2 Pharmaceutical use of substituted amides HIGH POINT PHARMACEUTICALS, LLC (US) 2013-02-26 US disclosed
US-8211925-B2 Benzamide glucokinase activators TRANSTECH PHARMA, INC. (US) 2012-07-03 US disclosed
US-8153798-B2 Indole- and benzimidazole amides as hydroxysteroid dehydrogenase inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2012-04-10 US disclosed
US-8138342-B2 11β-hydroxysteroid dehydrogenase type 1 active spiro compounds High Point Pharmacueticals, LLC (US) 2012-03-20 US disclosed
US-20120010194-A1 11-Beta-Hydroxysteroid Dehydrogenase Type 1 Active Compounds HIGH POINT PHARMACEUTICALS, LLC (US) 2012-01-12 US disclosed
US-20120004209-A1 11-Beta-Hydroxysteroid Dehydrogenase Type 1 Active Compounds HIGH POINT PHARMACEUTICALS, LLC (US) 2012-01-05 US disclosed
US-20110312949-A1 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES HIGH POINT PHARMACEUTICALS, LLC (US) 2011-12-22 US disclosed
US-8053431-B2 Pharmaceutical use of substituted amides HIGH POINT PHARMACEUTICALS, LLC (US) 2011-11-08 US disclosed
WO-2004089380-A2 PHARMACEUTICAL USE OF FUSED 1,2,4-TRIAZOLES NOVO NORDISK A/S (DK) 2004-10-21 WO disclosed
WO-2004089416-A2 COMBINATION OF AN 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITOR AND AN ANTIHYPERTENSIVE AGENT NOVO NORDISK A/S (DK) 2004-10-21 WO disclosed
WO-2004089470-A2 NEW AMIDE DERIVATIVES AND PHARMACEUTICAL USE THEREOF NOVO NORDISK A/S (DK) 2004-10-21 WO disclosed
WO-2004089471-A2 NEW PYRAZOLO[1,5-a] PYRIMIDINES DERIVATIVES AND PHARMACEUTICAL USE THEREOF NOVO NORDISK A/S (DK) 2004-10-21 WO disclosed
WO-2004089896-A1 11β-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE COMPOUNDS NOVO NORDISK A/S (DK) 2004-10-21 WO disclosed
US-6759533-B2 NOVEL INTERMEDIATES FOR THE SYNTHESIS OF CERTAIN NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. 2004-07-06 US disclosed
US-20040082570-A1 Xanthine derivative and DPPIV inhibitor EISAI CO., LTD. (JP) 2004-04-29 US disclosed
WO-2004002989-A1 PROCESS AND INTERMEDIATES FOR MAKING NON-NUCLEOSIDE HIV-1 REVERSE TRANSCRIPTASE INHIBITORS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2004-01-08 WO disclosed
US-20040002489-A1 Process and intermediates for making non-nucleoside HIV-1 reverse transcriptase inhibitors BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2004-01-01 US disclosed
EP-1338595-A2 Xanthine derivatives as DPP-IV inhibitors Eisai Co., Ltd. (JP) 2003-08-27 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 (5 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-20040082570-A1 Xanthine derivative and DPPIV inhibitor DPP4, DPP9, DPP7 MEN1 3419/4885MAPT 3970/4885KMT2A 2570/4885
US-20120004209-A1 11-Beta-Hydroxysteroid Dehydrogenase Type 1 Active Compounds HSD11B1, HSD3B1, HSD11B2 MEN1 1273/4885MAPT 3783/4885KMT2A 3823/4885
US-20120010194-A1 11-Beta-Hydroxysteroid Dehydrogenase Type 1 Active Compounds HSD11B1, HSD11B2, HSD3B1 MEN1 1805/4885MAPT 3899/4885KMT2A 3370/4885
US-20040002489-A1 Process and intermediates for making non-nucleoside HIV-1 reverse transcriptase inhibitors REV1, POLR2E, POLR2H MEN1 3062/4885MAPT 4017/4885KMT2A 2558/4885
US-20110312949-A1 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES HSD11B1, HSD3B1, HSD11B2 MEN1 2380/4885MAPT 3897/4885KMT2A 3134/4885

“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.