SCHEMBL2434247

SCHEMBL2434247

Cc1cc(C2CC2)cc(C)c1C1C(=O)NC2(CCCCC2)C1=O

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 3/20 0.33
KMT2A Q03164 2/20 0.33
HTR2A P28223 2/20 0.32
HTR2C P28335 2/20 0.32
HTR2B P41595 2/20 0.32
POLB P06746 1/20 0.32
RAB9A P51151 3/20 0.32
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPC1 O15118 1/20 0.30

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
SCHEMBL8652013 0.86 KMT2A (0.40) PDE7AKMT2APOLBRAB9AMAPT
SCHEMBL3176738 0.85 PDE7A (0.35) PDE7AKMT2APOLBRAB9AMAPT
SCHEMBL8645554 0.84 KMT2A (0.38) PDE7AKMT2APOLBRAB9AMAPT
SCHEMBL2759726 0.84 ADAM17 (0.32)
SCHEMBL12496896 0.83 PDE7A (0.40) PDE7AKMT2APOLBRAB9AMAPT
SCHEMBL1475886 0.81 KMT2A (0.37) PDE7AKMT2AHTR2AHTR2CHTR2B
SCHEMBL6994973 0.81 PDE7A (0.42) PDE7AKMT2APOLBNPC1
SCHEMBL2428035 0.80 HTR2A (0.35) HTR2AHTR2CHTR2B
SCHEMBL7619891 0.78 THRB (0.39) PDE7AMAPTSMN1; SMN2
SCHEMBL12496990 0.77 PDE7A (0.43) PDE7AKMT2A

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
US-8541617-B2 Cycloalkylphenyl substituted cyclic ketoenols BAYER CROPSCIENCE AG (DE) 2013-09-24 US disclosed
EP-1989162-B1 CYCLOALKYLPHENYL SUBSTITUTED CYCLIC KETOENOLS BAYER CROPSCIENCE AG (DE) 2013-07-03 EP 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
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-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
EP-1989162-A1 CYCLOALKYLPHENYL SUBSTITUTED CYCLIC KETOENOLS Bayer CropScience AG (DE) 2008-11-12 EP 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 PDE7A 1803/4885KMT2A 936/4885HTR2A 4678/4885
US-20090305891-A1 CYCLOALKYLPHENYL SUBSTITUTED CYCLIC KETOENOLS PHYKPL, KCNE1, PKM PDE7A 1978/4885KMT2A 1396/4885HTR2A 4614/4885

“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.