SCHEMBL4382858

SCHEMBL4382858

CC(C)CON=C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.54
HPGD P15428 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.52
HTT P42858 2/20 0.51
PKM P14618 2/20 0.48
PKLR P30613 1/20 0.48
KDM4E B2RXH2 1/20 0.47
LMNA P02545 2/20 0.46
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
HSD11B1 P28845 1/20 0.45
CNR1 P21554 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
CACNA1B Q00975 1/20 0.44

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
SCHEMBL4381817 0.91 GAA (0.56) GAAHPGDSMN1; SMN2HTTPKM
SCHEMBL4379438 0.87 HTT (0.51) GAAHPGDSMN1; SMN2HTTPKM
SCHEMBL4380828 0.87 SMN1; SMN2 (0.53) GAAHPGDSMN1; SMN2HTTPKM
SCHEMBL2292590 0.86 GAA (0.52) GAAHPGDSMN1; SMN2HTTPKM
SCHEMBL4385367 0.85 HTT (0.51) GAAHPGDSMN1; SMN2HTTPKM
SCHEMBL2290476 0.85 SMN1; SMN2 (0.48) GAAHPGDSMN1; SMN2HTTPKM
SCHEMBL2294255 0.84 SMN1; SMN2 (0.57) GAAHPGDSMN1; SMN2HTTLMNA
SCHEMBL2295183 0.84 GAA (0.52) GAAHPGDSMN1; SMN2HTTPKM
SCHEMBL4384419 0.84 HTT (0.50) GAAHPGDSMN1; SMN2HTTPKM
SCHEMBL2297519 0.84 HTT (0.53) GAASMN1; SMN2HTTPKMPKLR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF PURDUE PHARMA L.P. 2009-12-03 US disclosed
US-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF PURDUE PHARMA L.P. 2009-12-03 US disclosed
US-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF PURDUE PHARMA L.P. 2009-12-03 US 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-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF KCNN4, CACNA1A, KCNN3 GAA 3245/4885HPGD 1217/4885SMN1; SMN2 664/4885

“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.