SCHEMBL4385782

SCHEMBL4385782

O=S(=O)(c1cccc(OC(F)(F)F)c1)N1CCC(=NOCc2cccc(C(F)(F)F)c2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
HTT P42858 2/20 0.45
ALDH1A1 P00352 2/20 0.45
MAPT P10636 1/20 0.45
PPARG P37231 1/20 0.42
PPARD Q03181 1/20 0.42
PPARA Q07869 1/20 0.42
GAA P10253 1/20 0.42
RORC P51449 1/20 0.42
PKM P14618 1/20 0.41
PKLR P30613 1/20 0.41
CNR1 P21554 1/20 0.41
TP53 P04637 1/20 0.41
USP2 O75604 1/20 0.40
CYP17A1 P05093 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP21A2 P08686 1/20 0.40

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
SCHEMBL4391160 0.91 KMT2A (0.55) LMNASMN1; SMN2KMT2AMEN1HTT
SCHEMBL4385367 0.91 HTT (0.51) LMNASMN1; SMN2KMT2AMEN1HTT
SCHEMBL4379552 0.88 LMNA (0.52) LMNASMN1; SMN2KMT2AMEN1HTT
SCHEMBL4382720 0.87 LMNA (0.47) LMNASMN1; SMN2KMT2AMEN1HTT
SCHEMBL4391011 0.86 LMNA (0.54) LMNASMN1; SMN2KMT2AMEN1HTT
SCHEMBL4385767 0.84 TP53 (0.53) LMNASMN1; SMN2KMT2AMEN1HTT
SCHEMBL4388251 0.84 LMNA (0.45) LMNASMN1; SMN2KMT2AMEN1HTT
SCHEMBL4387315 0.84 LMNA (0.52) LMNASMN1; SMN2KMT2AMEN1HTT
SCHEMBL4387475 0.83 LMNA (0.51) LMNASMN1; SMN2KMT2AMEN1HTT
SCHEMBL4392904 0.83 LMNA (0.43) LMNASMN1; SMN2KMT2AMEN1HTT

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 LMNA 3822/4885SMN1; SMN2 664/4885KMT2A 2079/4885

“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.