SCHEMBL2285608

SCHEMBL2285608

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

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 5/20 0.42
SMN1; SMN2 Q16637 3/20 0.39
NR4A2 P43354 1/20 0.37
HTT P42858 3/20 0.36
ALDH1A1 P00352 1/20 0.36
HSP90AB1 P08238 3/20 0.35
LMNA P02545 2/20 0.35
SLC6A3 Q01959 1/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
KMT2A Q03164 1/20 0.33
TSHR P16473 2/20 0.32
MAPT P10636 1/20 0.32
XBP1 P17861 1/20 0.32
OPRM1 P35372 1/20 0.32
OPRL1 P41146 1/20 0.32

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
SCHEMBL2286121 0.92 HSP90AA1 (0.38) HSP90AA1SMN1; SMN2ALDH1A1HSP90AB1LMNA
SCHEMBL2289493 0.88 NR4A2 (0.43) HSP90AA1SMN1; SMN2NR4A2ALDH1A1HSP90AB1
SCHEMBL2289364 0.86 KMT2A (0.35) HSP90AA1SMN1; SMN2HTTALDH1A1SLC6A3
SCHEMBL2291626 0.86 HSP90AA1 (0.41) HSP90AA1SMN1; SMN2NR4A2HTTALDH1A1
SCHEMBL2286655 0.86 HSP90AA1 (0.41) HSP90AA1SMN1; SMN2NR4A2HTTALDH1A1
SCHEMBL2282979 0.84 HSP90AA1 (0.40) HSP90AA1SMN1; SMN2NR4A2HTTALDH1A1
SCHEMBL2292839 0.83 KDM4E (0.39) HSP90AA1HTTALDH1A1HSP90AB1LMNA
SCHEMBL2287286 0.80 HSP90AA1 (0.33) HSP90AA1SMN1; SMN2ALDH1A1HSP90AB1LMNA
SCHEMBL2286974 0.79 HSP90AA1 (0.41) HSP90AA1ALDH1A1HSP90AB1LMNACYP1A2
SCHEMBL2285463 0.78 HSP90AA1 (0.39) HSP90AA1SMN1; SMN2NR4A2HTTALDH1A1

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 HSP90AA1 3876/4885SMN1; SMN2 3491/4885NR4A2 1515/4885

“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.