SCHEMBL487397

SCHEMBL487397

CONCc1cnc(Cl)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.37
ALDH1A1 P00352 7/20 0.35
NPSR1 Q6W5P4 4/20 0.35
LMNA P02545 2/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 2/20 0.33
PDE5A O76074 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CHEK1 O14757 1/20 0.31

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
SCHEMBL2420112 0.79 SLC6A4 (0.40) ALDH1A1NPSR1MAPT
SCHEMBL361172 0.76 S1PR4 (0.40) ALDH1A1NPSR1LMNAPOLBMAPT
SCHEMBL18899210 0.74 SMN1; SMN2 (0.41) ALDH1A1NPSR1LMNAPOLBSMN1; SMN2
SCHEMBL8272903 0.72 ALDH1A1 (0.44) ALDH1A1NPSR1LMNAPOLBMAPT
SCHEMBL3710578 0.72 ALDH1A1 (0.50) TSHRALDH1A1LMNAPOLBMAPT
SCHEMBL3633110 0.72 ALDH1A1 (0.43) ALDH1A1NPSR1LMNAPOLBMAPT
SCHEMBL2419589 0.72 TSHR (0.45) TSHRALDH1A1NPSR1POLBMAPT
SCHEMBL6077369 0.72 TSHR (0.61) TSHRALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL1008998 0.70 PDE1B (0.38) ALDH1A1NPSR1LMNAPOLBMAPT
SCHEMBL7993695 0.70 ROCK1 (0.35) ALDH1A1NPSR1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2004606-B1 SUBSTITUTED ENAMINOCARBONYL COMPOUNDS BAYER CROPSCIENCE AG (DE) 2013-04-24 EP disclosed
US-8106212-B2 Substituted enaminocarbonyl compounds BAYER CROPSCIENCE AG (DE) 2012-01-31 US disclosed
US-8106212-B2 Substituted enaminocarbonyl compounds BAYER CROPSCIENCE AG (DE) 2012-01-31 US disclosed
US-20090247551-A1 SUBSTITUTED ENAMINOCARBONYL COMPOUNDS BAYER CROPSCIENCE AG (DE) 2009-10-01 US disclosed
US-20090247551-A1 SUBSTITUTED ENAMINOCARBONYL COMPOUNDS BAYER CROPSCIENCE AG (DE) 2009-10-01 US disclosed
EP-2004606-A1 SUBSTITUTED ENAMINOCARBONYL COMPOUNDS Bayer CropScience AG (DE) 2008-12-24 EP disclosed
WO-2007115643-A1 SUBSTITUTED ENAMINOCARBONYL COMPOUNDS BAYER CROPSCIENCE AG (DE) 2007-10-18 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-20090247551-A1 SUBSTITUTED ENAMINOCARBONYL COMPOUNDS DDT, NPEPPS, L3MBTL4 TSHR 4252/4885ALDH1A1 4014/4885NPSR1 3112/4885

“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.