SCHEMBL2284828

SCHEMBL2284828

COc1cc(OC)nc(C(Cl)c2cccc(OC(F)(F)F)c2N)n1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 3/20 0.33
HSP90AB1 P08238 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
MPL P40238 1/20 0.33
KCNK3 O14649 2/20 0.33
KCNK9 Q9NPC2 2/20 0.33
PDE2A O00408 1/20 0.33
PDE10A Q9Y233 1/20 0.33
PIM1 P11309 1/20 0.32
SCN10A Q9Y5Y9 1/20 0.31
HRH4 Q9H3N8 1/20 0.31
SCN9A Q15858 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
SCHEMBL2291153 0.83 KCNK3 (0.33) KDM4EALDH1A1HPGDMPLKCNK3
SCHEMBL2285840 0.81 NPC1 (0.34) HSP90AA1HSP90AB1KDM4EALDH1A1HPGD
SCHEMBL2286121 0.79 HSP90AA1 (0.38) HSP90AA1HSP90AB1KDM4EALDH1A1HPGD
SCHEMBL2289104 0.78 ALDH1A1 (0.33) HSP90AA1HSP90AB1KDM4EALDH1A1HPGD
SCHEMBL2289411 0.78 ALDH1A1 (0.33) HSP90AA1HSP90AB1KDM4EALDH1A1HPGD
SCHEMBL2292839 0.76 KDM4E (0.39) HSP90AA1HSP90AB1KDM4EALDH1A1HPGD
SCHEMBL2287340 0.76 GAA (0.39) KDM4EALDH1A1HPGD
SCHEMBL2289364 0.74 KMT2A (0.35) HSP90AA1ALDH1A1
SCHEMBL2286531 0.73 TDO2 (0.32) ALDH1A1
SCHEMBL2285608 0.72 HSP90AA1 (0.42) HSP90AA1HSP90AB1ALDH1A1

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
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 HSP90AA1 3876/4885HSP90AB1 3783/4885KDM4E 1374/4885

“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.