SCHEMBL4256879

SCHEMBL4256879

NC1CCN(c2cccc(S(=O)(=O)C(F)(F)F)c2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
MAPK1 P28482 2/20 0.47
HTT P42858 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MAPT P10636 1/20 0.45
RECQL P46063 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
HTR6 P50406 5/20 0.44
HTR2B P41595 4/20 0.44
GPR119 Q8TDV5 1/20 0.42
VCP P55072 1/20 0.41
CYP3A4 P08684 1/20 0.40
ALDH1A1 P00352 1/20 0.40
SFRP1 Q8N474 1/20 0.39
MCOLN2 Q8IZK6 1/20 0.39
MCOLN3 Q8TDD5 1/20 0.39
MCOLN1 Q9GZU1 1/20 0.39
DRD2 P14416 1/20 0.39
NR1H2 P55055 3/20 0.39
NR1H3 Q13133 2/20 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
SCHEMBL32665545 0.84 HTR6 (0.49) HTR6HTR2BGPR119VCPCYP3A4
SCHEMBL16966426 0.82 CA1 (0.48) LMNAHTR6HTR2BGPR119VCP
SCHEMBL2301921 0.82 LMNA (0.64) LMNAMAPK1HTTSMN1; SMN2MAPT
SCHEMBL3454917 0.80 HTR6 (0.65) LMNAMAPK1HTTSMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL11370762 0.79 HTR6 (0.63) LMNAMAPK1HTTSMN1; SMN2MAPT
SCHEMBL1704801 0.75 ALDH1A1 (0.62) LMNAMAPK1HTTSMN1; SMN2MAPT
SCHEMBL3453542 0.75 DRD2 (0.72) LMNAMAPK1SMN1; SMN2MAPTRECQL
Bromide SCHEMBL9310896 0.74 ALDH1A1 (0.60) LMNAMAPK1HTTSMN1; SMN2MAPT
SCHEMBL21624833 0.73 NR1H2 (0.54) GPR119DRD2NR1H2NR1H3
SCHEMBL21624835 0.73 NR1H2 (0.54) GPR119DRD2NR1H2NR1H3

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-20090215818-A1 THIOZOLIDINEDIONE DERIVATIVES AS PI3 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-08-27 US disclosed
EP-2046333-A2 THIOZOLIDINEDIONE DERIVATIVES AS P13 KINASE INHIBITORS SmithKline Beecham Corporation (US) 2009-04-15 EP disclosed
WO-2008014219-A2 THIOZOLIDINEDIONE DERIVATIVES AS P13 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-01-31 WO 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-20090215818-A1 THIOZOLIDINEDIONE DERIVATIVES AS PI3 KINASE INHIBITORS PIK3CD, PI4KA, PIP4K2A LMNA 4882/4885MAPK1 784/4885HTT 1416/4885

“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.