SCHEMBL4383719

SCHEMBL4383719

CN(C)c1cccc(CON=C2CCN(S(=O)(=O)c3ccc(OC(F)(F)F)cc3)CC2)c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.42
KMT2A Q03164 6/20 0.42
LMNA P02545 5/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 4/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
SCN9A Q15858 1/20 0.38
CYP2C9 P11712 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37
PKM P14618 2/20 0.37
POLB P06746 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
EPHX2 P34913 1/20 0.36
KDM2B Q8NHM5 1/20 0.36
LIPE Q05469 1/20 0.36

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
SCHEMBL4383670 0.86 CYP2C9 (0.43) MEN1KMT2AALDH1A1SCN9ACYP2C9
SCHEMBL4391160 0.86 KMT2A (0.55) MEN1KMT2ALMNASMN1; SMN2ALDH1A1
SCHEMBL4380572 0.86 MEN1 (0.43) MEN1KMT2ALMNASMN1; SMN2ALDH1A1
SCHEMBL4388925 0.85 GBA1 (0.45) MEN1KMT2AALDH1A1CYP2C9GAA
SCHEMBL4380227 0.84 MRGPRX4 (0.56) MEN1KMT2AALDH1A1SCN9ACYP2C9
SCHEMBL4384418 0.84 MRGPRX4 (0.54) MEN1KMT2AALDH1A1CYP2C9GAA
SCHEMBL4388230 0.84 MEN1 (0.46) MEN1KMT2ALMNASMN1; SMN2ALDH1A1
SCHEMBL4385286 0.83 CYP2C9 (0.48) MEN1KMT2ALMNAALDH1A1SCN9A
SCHEMBL4385844 0.82 SCN9A (0.52) MEN1KMT2AALDH1A1SCN9ACYP2C9
SCHEMBL4395594 0.81 MEN1 (0.39) MEN1KMT2ALMNASMN1; SMN2ALDH1A1

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 MEN1 3694/4885KMT2A 2079/4885LMNA 3822/4885

“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.