SCHEMBL4384762

SCHEMBL4384762

CCCCc1ccc(S(=O)(=O)N2CCC(=NOCc3ccccc3C(F)(F)F)CC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.46
ALDH1A1 P00352 4/20 0.46
CYP2C9 P11712 2/20 0.46
CYP2C19 P33261 2/20 0.46
CYP3A4 P08684 1/20 0.46
GAA P10253 1/20 0.46
CYP2D6 P10635 1/20 0.46
KDM4E B2RXH2 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
HPGD P15428 1/20 0.45
RECQL P46063 1/20 0.44
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
F13A1 P00488 1/20 0.41
TGM2 P21980 1/20 0.41
TGM1 P22735 1/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
ATM Q13315 1/20 0.41
FAAH O00519 1/20 0.39

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
SCHEMBL4383812 0.85 LMNA (0.48) HSD11B1ALDH1A1CYP2C19GAARECQL
SCHEMBL4376994 0.84 HSD11B1 (0.42) HSD11B1ALDH1A1CYP2C19GAARECQL
SCHEMBL4393905 0.84 SMN1; SMN2 (0.49) HSD11B1ALDH1A1CYP2C9CYP2C19GAA
SCHEMBL4381771 0.83 LMNA (0.50) HSD11B1ALDH1A1CYP2C19GAALMNA
SCHEMBL4551485 0.80 NPSR1 (0.57) ALDH1A1CYP2C9CYP2C19CYP3A4GAA
SCHEMBL4387319 0.79 ALDH1A1 (0.47) ALDH1A1CYP2C9CYP2C19CYP3A4GAA
SCHEMBL4376950 0.79 LMNA (0.42) ALDH1A1GAALMNASMN1; SMN2KMT2A
SCHEMBL4386313 0.79 SMN1; SMN2 (0.43) HSD11B1ALDH1A1CYP2C9KDM4ERECQL
SCHEMBL4395422 0.79 SMN1; SMN2 (0.39) ALDH1A1GAATDP1LMNASMN1; SMN2
SCHEMBL4381821 0.79 LMNA (0.46) ALDH1A1RECQLLMNASMN1; SMN2KMT2A

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 HSD11B1 1648/4885ALDH1A1 2105/4885CYP2C9 114/4885

“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.