SCHEMBL40440

SCHEMBL40440

O=C1CCC(=O)N1CCc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.67
GAA P10253 5/20 0.67
MEN1 O00255 4/20 0.67
MAPT P10636 3/20 0.67
HSD17B10 Q99714 2/20 0.67
HTT P42858 2/20 0.67
USP2 O75604 1/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
GSK3A P49840 2/20 0.62
GSK3B P49841 2/20 0.62
MGLL Q99685 1/20 0.62
CA1 P00915 1/20 0.59
CA2 P00918 1/20 0.59
CA4 P22748 1/20 0.59
CA9 Q16790 1/20 0.59
TSHR P16473 1/20 0.58
ALDH1A1 P00352 6/20 0.56
RAB9A P51151 2/20 0.56
APAF1 O14727 1/20 0.56
CASP1 P29466 1/20 0.56

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
SCHEMBL9390734 0.92 KMT2A (0.62) KMT2AGAAMEN1MAPTHSD17B10
SCHEMBL40501 0.88 GSK3A (0.65) KMT2AGAAMEN1MAPTHSD17B10
SCHEMBL6225797 0.80 CA2 (0.60) KMT2AGAAMEN1MAPTHSD17B10
SCHEMBL4154508 0.80 ALDH1A1 (0.61) KMT2AGAAMEN1MAPTHSD17B10
SCHEMBL7793890 0.80 CA1 (0.60) KMT2AGAAMEN1MAPTHSD17B10
SCHEMBL22980462 0.80 CA1 (0.60) KMT2AGAAMEN1MAPTHSD17B10
SCHEMBL10158776 0.80 KMT2A (1.00) KMT2AGAAMEN1MAPTHSD17B10
SCHEMBL16334884 0.80 KMT2A (0.59) KMT2AGAAMEN1MAPTHSD17B10
SCHEMBL9802993 0.79 KMT2A (0.49) KMT2AGAAMEN1MAPTHSD17B10
SCHEMBL290791 0.78 POLB (0.70) KMT2AMEN1MAPTUSP2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1513530-A4 TETRAHYDROQUINOLINES FOR MODULATING THE EXPRESSION OF EXOGENOUS GENES VIA AN ECDYSONE RECEPTOR COMPLEX INTREXON CORP (US) 2009-04-01 EP claimed
US-20050228016-A1 TETRAHYDROQUINOLINES FOR MODULATING THE EXPRESSION OF EXOGENOUS GENES VIA AN ECDYSONE RECEPTOR COMPLEX MICHELOTTI ENRIQUE 2005-10-13 US claimed
EP-1513530-A1 TETRAHYDROQUINOLINES FOR MODULATING THE EXPRESSION OF EXOGENOUS GENES VIA AN ECDYSONE RECEPTOR COMPLEX RheoGene, Inc. (US) 2005-03-16 EP claimed
WO-2003105849-A1 TETRAHYDROQUINOLINES FOR MODULATING THE EXPRESSION OF EXOGENOUS GENES VIA AN ECDYSONE RECEPTOR COMPLEX RHEOGENE, INC. (US) 2003-12-24 WO claimed
EP-4289883-A1 CURABLE RESIN COMPOSITION ADEKA CORPORATION (JP) 2023-12-13 EP disclosed
US-20230372915-A1 MANGANESE BASED COMPLEXES AND USES THEREOF FOR HOMOGENEOUS CATALYSIS YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2023-11-23 US disclosed
US-20230372915-A1 MANGANESE BASED COMPLEXES AND USES THEREOF FOR HOMOGENEOUS CATALYSIS YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2023-11-23 US disclosed
US-11731116-B2 Manganese based complexes and uses thereof for homogeneous catalysis YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2023-08-22 US disclosed
US-11731116-B2 Manganese based complexes and uses thereof for homogeneous catalysis YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2023-08-22 US disclosed
EP-3919466-A1 MANGANESE BASED COMPLEXES AND USES THEREOF FOR HOMOGENEOUS CATALYSIS Yeda Research and Development Co. Ltd (IL) 2021-12-08 EP disclosed
US-20170275600-A1 MODIFIED FORMS OF PSEUDOMONAS EXOTOXIN A INTREXON CORPORATION (US) 2017-09-28 US disclosed
WO-2017137984-A1 MANGANESE BASED COMPLEXES AND USES THEREOF FOR HOMOGENEOUS CATALYSIS YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2017-08-17 WO disclosed
EP-1513530-A4 TETRAHYDROQUINOLINES FOR MODULATING THE EXPRESSION OF EXOGENOUS GENES VIA AN ECDYSONE RECEPTOR COMPLEX INTREXON CORP (US) 2009-04-01 EP disclosed
US-20060211724-A1 Hiv integrase inhibitors VERSCHUEREN GASTON W 2006-09-21 US disclosed
CN-1812992-A HIV integrase inhibitors TIBOTEC PHARM LTD (IE) 2006-08-02 CN disclosed
EP-1625130-A2 HIV INTEGRASE INHIBITORS Tibotec Pharmaceuticals Ltd. (IE) 2006-02-15 EP disclosed
US-20050228016-A1 TETRAHYDROQUINOLINES FOR MODULATING THE EXPRESSION OF EXOGENOUS GENES VIA AN ECDYSONE RECEPTOR COMPLEX MICHELOTTI ENRIQUE 2005-10-13 US disclosed
EP-1513530-A1 TETRAHYDROQUINOLINES FOR MODULATING THE EXPRESSION OF EXOGENOUS GENES VIA AN ECDYSONE RECEPTOR COMPLEX RheoGene, Inc. (US) 2005-03-16 EP disclosed
WO-2004096807-A2 HIV INTEGRASE INHIBITORS TIBOTEC PHARMACEUTICALS LTD. (IE) 2004-11-11 WO disclosed
WO-2003105849-A1 TETRAHYDROQUINOLINES FOR MODULATING THE EXPRESSION OF EXOGENOUS GENES VIA AN ECDYSONE RECEPTOR COMPLEX RHEOGENE, INC. (US) 2003-12-24 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 (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-20230372915-A1 MANGANESE BASED COMPLEXES AND USES THEREOF FOR HOMOGENEOUS CATALYSIS ADH1C, OTC, MLEC KMT2A 843/4885GAA 2912/4885MEN1 32/4885
US-20170275600-A1 MODIFIED FORMS OF PSEUDOMONAS EXOTOXIN A CD4, CD47, CD14 KMT2A 2781/4885GAA 1549/4885MEN1 3041/4885
US-20050228016-A1 TETRAHYDROQUINOLINES FOR MODULATING THE EXPRESSION OF EXOGENOUS GENES VIA AN ECDYSONE RECEPTOR COMPLEX NR2E3, GTF2E2, NR2C2 KMT2A 1402/4885GAA 4624/4885MEN1 3576/4885
US-11731116-B2 Manganese based complexes and uses thereof for homogeneous catalysis ADH1C, OTC, ADH5 KMT2A 990/4885GAA 3056/4885MEN1 41/4885
US-20060211724-A1 Hiv integrase inhibitors SULT1A1, SULT2A1, SULT1E1 KMT2A 1121/4885GAA 3995/4885MEN1 4634/4885

“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.