SCHEMBL2430037

SCHEMBL2430037

CCOC(=O)N1CCCCN1C(=O)Cc1c(C)cc(C2CC2)cc1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.35
MEN1 O00255 5/20 0.35
PDE4B Q07343 1/20 0.34
OPRM1 P35372 1/20 0.34
OPRK1 P41145 1/20 0.34
PKM P14618 1/20 0.34
ALDH1A1 P00352 5/20 0.33
KDM4E B2RXH2 3/20 0.33
LMNA P02545 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
HCRTR2 O43614 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
POLB P06746 1/20 0.33
ADAM17 P78536 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL8950560 0.85 MEN1 (0.43) KMT2AMEN1ALDH1A1LMNASMN1; SMN2
SCHEMBL3169396 0.83 MEN1 (0.35) KMT2AMEN1ALDH1A1KDM4ELMNA
SCHEMBL10309326 0.79 KMT2A (0.33) KMT2AMEN1OPRM1OPRK1ALDH1A1
SCHEMBL13527339 0.79 MEN1 (0.40) KMT2AMEN1SMN1; SMN2HPGDNPSR1
SCHEMBL3761042 0.76 LMNA (0.40) KMT2AMEN1ALDH1A1KDM4ELMNA
SCHEMBL1152756 0.75 ALDH1A1 (0.38) KMT2AMEN1ALDH1A1KDM4ECYP1A2
SCHEMBL14335874 0.73 KMT2A (0.40) KMT2AMEN1ALDH1A1KDM4ELMNA
SCHEMBL2431064 0.73 MAPT (0.35) KMT2AMEN1PKMALDH1A1KDM4E
SCHEMBL4575872 0.72 KDM4E (0.35) KMT2AMEN1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL14405323 0.72 ALDH1A1 (0.34) KMT2AMEN1ALDH1A1KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8541617-B2 Cycloalkylphenyl substituted cyclic ketoenols BAYER CROPSCIENCE AG (DE) 2013-09-24 US disclosed
US-8541617-B2 Cycloalkylphenyl substituted cyclic ketoenols BAYER CROPSCIENCE AG (DE) 2013-09-24 US disclosed
US-8541617-B2 Cycloalkylphenyl substituted cyclic ketoenols BAYER CROPSCIENCE AG (DE) 2013-09-24 US disclosed
US-20120178927-A1 CYCLOALKYLPHENYL SUBSTITUTED CYCLIC KETOENOLS BAYER CROPSCIENCE AG (DE) 2012-07-12 US disclosed
US-20120178927-A1 CYCLOALKYLPHENYL SUBSTITUTED CYCLIC KETOENOLS BAYER CROPSCIENCE AG (DE) 2012-07-12 US disclosed
US-20120178927-A1 CYCLOALKYLPHENYL SUBSTITUTED CYCLIC KETOENOLS BAYER CROPSCIENCE AG (DE) 2012-07-12 US disclosed
US-8013172-B2 Cycloalkylphenyl substituted cyclic ketoenols BAYER CROPSCIENCE AG (DE) 2011-09-06 US disclosed
US-8013172-B2 Cycloalkylphenyl substituted cyclic ketoenols BAYER CROPSCIENCE AG (DE) 2011-09-06 US disclosed
US-8013172-B2 Cycloalkylphenyl substituted cyclic ketoenols BAYER CROPSCIENCE AG (DE) 2011-09-06 US disclosed
EP-2186791-A1 Cycloalkyl-phenyl-substituted cyclic ketoenoles Bayer CropScience AG (DE) 2010-05-19 EP disclosed
EP-2186805-A1 Cycloalkyl-phenyl-substituted cyclic ketoenoles Bayer CropScience AG (DE) 2010-05-19 EP disclosed
EP-2186805-A1 Cycloalkyl-phenyl-substituted cyclic ketoenoles Bayer CropScience AG (DE) 2010-05-19 EP disclosed
EP-2186791-A1 Cycloalkyl-phenyl-substituted cyclic ketoenoles Bayer CropScience AG (DE) 2010-05-19 EP disclosed
EP-2184275-A1 Cycloalkyl-phenyl-substituted cyclic ketoenoles Bayer CropScience AG (DE) 2010-05-12 EP disclosed
EP-2184275-A1 Cycloalkyl-phenyl-substituted cyclic ketoenoles Bayer CropScience AG (DE) 2010-05-12 EP disclosed
US-20090305891-A1 CYCLOALKYLPHENYL SUBSTITUTED CYCLIC KETOENOLS BAYER CROPSCIENCE AG (DE) 2009-12-10 US disclosed
US-20090305891-A1 CYCLOALKYLPHENYL SUBSTITUTED CYCLIC KETOENOLS BAYER CROPSCIENCE AG (DE) 2009-12-10 US disclosed
US-20090305891-A1 CYCLOALKYLPHENYL SUBSTITUTED CYCLIC KETOENOLS BAYER CROPSCIENCE AG (DE) 2009-12-10 US disclosed
WO-2007096058-A1 CYCLOALKYLPHENYL SUBSTITUTED CYCLIC KETOENOLS BAYER CROPSCIENCE AG (DE) 2007-08-30 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 (2 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-20120178927-A1 CYCLOALKYLPHENYL SUBSTITUTED CYCLIC KETOENOLS PHYKPL, KCNE1, PIKFYVE KMT2A 936/4885MEN1 4700/4885PDE4B 1885/4885
US-20090305891-A1 CYCLOALKYLPHENYL SUBSTITUTED CYCLIC KETOENOLS PHYKPL, KCNE1, PKM KMT2A 1396/4885MEN1 4818/4885PDE4B 1923/4885

“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.