SCHEMBL13588993

SCHEMBL13588993

CCCNc1ccc(S(=O)(=O)N2CCC(=NOCc3cccc(C(F)(F)F)c3)CC2)cn1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.45
ATM Q13315 1/20 0.45
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A1 P00352 4/20 0.44
KDM4E B2RXH2 3/20 0.44
MAPT P10636 2/20 0.42
HTT P42858 1/20 0.42
CYP2C19 P33261 1/20 0.39
ADORA2A P29274 2/20 0.39
ADORA2B P29275 2/20 0.39
ADORA1 P30542 2/20 0.39
ADORA3 P0DMS8 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL4384490 0.89 L3MBTL1 (0.49) L3MBTL1ATMLMNASMN1; SMN2ALDH1A1
SCHEMBL4386010 0.86 KDM4E (0.47) L3MBTL1ATMLMNASMN1; SMN2ALDH1A1
SCHEMBL4395449 0.86 CCR6 (0.49) L3MBTL1ATMLMNASMN1; SMN2ALDH1A1
SCHEMBL4384735 0.85 LMNA (0.47) LMNASMN1; SMN2ALDH1A1KDM4EMAPT
SCHEMBL4380308 0.84 LMNA (0.47) L3MBTL1ATMLMNASMN1; SMN2ALDH1A1
SCHEMBL4380169 0.84 SMN1; SMN2 (0.47) L3MBTL1LMNASMN1; SMN2ALDH1A1KDM4E
SCHEMBL4381146 0.83 LMNA (0.46) ATMLMNASMN1; SMN2ALDH1A1KDM4E
SCHEMBL4386302 0.82 KDM4E (0.48) L3MBTL1LMNASMN1; SMN2ALDH1A1KDM4E
SCHEMBL4380224 0.82 LMNA (0.45) LMNASMN1; SMN2ALDH1A1KDM4EMAPT
SCHEMBL4395322 0.82 LMNA (0.45) LMNASMN1; SMN2ALDH1A1KDM4EMAPT

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 2 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

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 L3MBTL1 2099/4885ATM 4309/4885LMNA 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.