SCHEMBL2283689

SCHEMBL2283689

COc1cc(OC)nc(Cc2ccc(Cl)c(Cl)c2N)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.36
HTT P42858 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
ALDH1A1 P00352 3/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HSP90AA1 P07900 2/20 0.31
HSP90AB1 P08238 2/20 0.31
KDM4E B2RXH2 1/20 0.31
HSD17B10 Q99714 1/20 0.31
IDH1 O75874 1/20 0.31
LMNA P02545 1/20 0.31
HPGD P15428 1/20 0.31
PDCD1LG2 Q9BQ51 1/20 0.31
CD274 Q9NZQ7 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
SCHEMBL2288933 0.86 PDE2A (0.35) PDE2AHTTSMN1; SMN2GAAMAPT
SCHEMBL2286210 0.86 PDCD1LG2 (0.37) PDE2AHTTSMN1; SMN2GAAMAPT
SCHEMBL2287061 0.84 GAA (0.35) HTTSMN1; SMN2GAAMAPTTSHR
SCHEMBL2288462 0.82 PDE2A (0.42) PDE2AMAPK1ALDH1A1NPC1RAB9A
SCHEMBL2285990 0.79 PDE2A (0.38) PDE2AHTTSMN1; SMN2MAPTALDH1A1
SCHEMBL2286692 0.78 PDE2A (0.34) PDE2AHTTSMN1; SMN2GAAMAPT
SCHEMBL2285267 0.77 PDE2A (0.36) PDE2AHTTSMN1; SMN2GAAMAPT
SCHEMBL2287303 0.75 PDE2A (0.33) PDE2AGAAALDH1A1NPC1HSP90AA1
SCHEMBL2286122 0.75 HSP90AA1 (0.43) PDE2AHTTSMN1; SMN2TSHRALDH1A1
SCHEMBL3775535 0.75 ALDH1A1 (0.43) PDE2AHTTGAAMAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1773124-B1 A USE OF SULFONANILIDES AS AGRICULTURAL AND HORTICULTURAL FUNGICIDE BAYER CROPSCIENCE AG (DE) 2012-08-22 EP disclosed
US-8008484-B2 Use of sulfonanilides as agricultural and horticultural fungicide BAYER CROPSCIENCE AG (DE) 2011-08-30 US disclosed
US-20070219199-A1 Use of Sulfonanilides as Agricultural and Horticultural Fungicide BAYER CROPSCIENCE AG (DE) 2007-09-20 US disclosed
EP-1773124-A1 A USE OF SULFONANILIDES AS AGRICULTURAL AND HORTICULTURAL FUNGICIDE Bayer CropScience Aktiengesellschaft (DE) 2007-04-18 EP disclosed
WO-2006008159-A1 A USE OF SULFONANILIDES AS AGRICULTURAL AND HORTICULTURAL FUNGICIDE BAYER CROPSCIENCE AG (DE) 2006-01-26 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-20070219199-A1 Use of Sulfonanilides as Agricultural and Horticultural Fungicide CBR3, CYP51A1, CBR1 PDE2A 2578/4885HTT 1936/4885SMN1; SMN2 3491/4885

“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.