SCHEMBL2899236

SCHEMBL2899236

CCC(=O)Nc1c[c]ccc1OC

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.55
SMN1; SMN2 Q16637 4/20 0.49
MAPT P10636 1/20 0.49
MAPK1 P28482 1/20 0.49
AHR P35869 1/20 0.49
KMT2A Q03164 6/20 0.44
MEN1 O00255 3/20 0.44
GAA P10253 2/20 0.44
ALDH1A1 P00352 4/20 0.42
POLB P06746 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL2900768 0.88 LMNA (0.49) HTTMAPK1GAAALDH1A1POLB
SCHEMBL2902630 0.86 KMT2A (0.58) SMN1; SMN2KMT2AMEN1GAAALDH1A1
SCHEMBL3002053 0.84 ALDH1A1 (0.51) HTTSMN1; SMN2MAPTKMT2AMEN1
SCHEMBL1355596 0.82 ALDH1A1 (0.45) HTTSMN1; SMN2MAPTMAPK1KMT2A
SCHEMBL1355211 0.82 KMT2A (0.52) MAPTKMT2AMEN1GAAALDH1A1
SCHEMBL3001126 0.81 MEN1 (0.60) SMN1; SMN2MAPTKMT2AMEN1GAA
SCHEMBL2900696 0.80 ALDH1A1 (0.47) HTTSMN1; SMN2MAPTKMT2AMEN1
SCHEMBL2897540 0.80 KDM4E (0.50) HTTSMN1; SMN2MAPTMAPK1KMT2A
SCHEMBL2900503 0.79 KDM4E (0.48) MAPTKMT2AMEN1GAAALDH1A1
SCHEMBL1355851 0.79 SMN1; SMN2 (0.56) SMN1; SMN2MAPTKMT2AGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101367749-B A set of mesidino mesitoyl derivant, preparation and application thereof INST MEDICINAL BIOTECHNOLOGY 2013-04-24 CN disclosed
US-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides BAYER CROPSCIENCE AG (DE) 2010-12-02 US disclosed
EP-2236505-A1 Acylated aminopyridines and pyridazines as insecticides Bayer CropScience AG (DE) 2010-10-06 EP disclosed
CN-101367749-A A set of mesidino mesitoyl derivant, preparation and application thereof MEDICINE AND BIOENGINEERING IN (CN) 2009-02-18 CN 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-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides AAAS, DDT, QDPR HTT 2101/4885SMN1; SMN2 2519/4885MAPT 3480/4885

“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.