SCHEMBL4384743

SCHEMBL4384743

N#Cc1ccnc(CON=C2CCN(S(=O)(=O)c3cccc(F)c3)CC2)c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 3/20 0.39
PKM P14618 2/20 0.37
PKLR P30613 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
MEN1 O00255 1/20 0.37
GFER P55789 1/20 0.37
KMT2A Q03164 1/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
AKR1C3 P42330 2/20 0.36
AKR1C1 Q04828 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HTR6 P50406 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
SCHEMBL4384904 0.93 SCN9A (0.39) SCN9AAKR1C3AKR1C1ATML3MBTL1
SCHEMBL8222754 0.90 GPR6 (0.40) SCN9APKMMEN1KMT2AL3MBTL1
SCHEMBL4379530 0.89 GAA (0.45) MEN1KMT2AAKR1C3AKR1C1ATM
SCHEMBL4393773 0.89 HSD11B1 (0.44) PKMPKLR
SCHEMBL4377008 0.87 CYP11B1 (0.39) SCN9AMEN1KMT2AAKR1C3AKR1C1
SCHEMBL4388309 0.87 GAA (0.47) PKMPKLRMEN1KMT2AL3MBTL1
SCHEMBL4386017 0.86 KDM4E (0.39) MEN1KMT2AL3MBTL1
SCHEMBL4384547 0.84 CCR6 (0.42) PKMTDP1MEN1KMT2ASMN1; SMN2
SCHEMBL4388899 0.82 PKM (0.37) PKMPKLRMEN1KMT2AL3MBTL1
SCHEMBL4380261 0.82 MEN1 (0.42) MEN1KMT2AL3MBTL1

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 SCN9A 270/4885PKM 2106/4885PKLR 985/4885

“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.