SCHEMBL2288933

SCHEMBL2288933

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 2/20 0.35
MPO P05164 2/20 0.33
TDO2 P48775 1/20 0.32
HTR2A P28223 2/20 0.32
HTR2C P28335 2/20 0.32
HTR2B P41595 2/20 0.32
HTT P42858 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
ALDH1A1 P00352 2/20 0.31
ADORA2B P29275 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
HSP90AA1 P07900 1/20 0.30
HSP90AB1 P08238 1/20 0.30
PTGES O14684 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
SCHEMBL2283689 0.86 PDE2A (0.36) PDE2AHTTSMN1; SMN2GAAMAPT
SCHEMBL2285267 0.86 PDE2A (0.36) PDE2ATDO2HTTSMN1; SMN2GAA
SCHEMBL2286210 0.83 PDCD1LG2 (0.37) PDE2AMPOTDO2HTR2AHTR2C
SCHEMBL2288462 0.80 PDE2A (0.42) PDE2AMPOMAPK1ALDH1A1NPC1
SCHEMBL2287303 0.79 PDE2A (0.33) PDE2ATDO2GAAALDH1A1NPC1
SCHEMBL2287239 0.78 MEN1 (0.37) PDE2AMPOTDO2HTTSMN1; SMN2
SCHEMBL2289592 0.78 MEN1 (0.37) PDE2AMPOTDO2HTTSMN1; SMN2
SCHEMBL2283366 0.77 PDE2A (0.39) PDE2AMPOALDH1A1ADORA2BNPC1
SCHEMBL2285990 0.77 PDE2A (0.38) PDE2AHTTSMN1; SMN2MAPTALDH1A1
SCHEMBL2291721 0.76 PDCD1LG2 (0.33) PDE2AMPOTDO2

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 2578/4885MPO 1620/4885TDO2 637/4885

“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.