SCHEMBL4376971

SCHEMBL4376971

CCCCc1ccc(S(=O)(=O)N2CCC(=NOCc3cc(F)cc(Cl)c3)CC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.40
LMNA P02545 3/20 0.40
FAAH O00519 1/20 0.39
MGLL Q99685 1/20 0.39
CD4 P01730 2/20 0.39
FFAR1 O14842 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
GAA P10253 2/20 0.38
ALDH1A1 P00352 3/20 0.38
PKM P14618 2/20 0.38
HTT P42858 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
DRD2 P14416 1/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37

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
SCHEMBL4387319 0.88 ALDH1A1 (0.47) SMN1; SMN2LMNAFAAHMGLLGAA
SCHEMBL4385481 0.87 LMNA (0.49) SMN1; SMN2LMNAFAAHMGLLCD4
SCHEMBL4395422 0.85 SMN1; SMN2 (0.39) SMN1; SMN2LMNAFAAHMGLLCD4
SCHEMBL4376994 0.83 HSD11B1 (0.42) SMN1; SMN2LMNAFAAHMGLLCD4
SCHEMBL4393905 0.83 SMN1; SMN2 (0.49) SMN1; SMN2LMNAFAAHMGLLGAA
SCHEMBL4385187 0.82 IKBKB (0.42) SMN1; SMN2LMNAFAAHMGLLCD4
SCHEMBL4383812 0.82 LMNA (0.48) SMN1; SMN2LMNAFAAHMGLLCD4
SCHEMBL4393979 0.81 IKBKB (0.41) SMN1; SMN2LMNAFAAHMGLLCD4
SCHEMBL4381821 0.81 LMNA (0.46) SMN1; SMN2LMNAFAAHMGLLCD4
SCHEMBL4381771 0.80 LMNA (0.50) SMN1; SMN2LMNAGAAALDH1A1HTT

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 SMN1; SMN2 664/4885LMNA 3822/4885FAAH 1521/4885

“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.