SCHEMBL23345388

SCHEMBL23345388

CC(C)(C)NS(=O)(=O)c1ccccc1S(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 2/20 0.51
MAPT P10636 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.47
LMNA P02545 1/20 0.47
HPGD P15428 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
PARG Q86W56 1/20 0.46
ALDH1A1 P00352 3/20 0.46
ALOX5AP P20292 10/20 0.42
FEN1 P39748 10/20 0.42
SIRT2 Q8IXJ6 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
MAPK1 P28482 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
SCHEMBL2803354 0.91 NSD2 (0.58) NSD2MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL13075810 0.88 NSD2 (0.51) NSD2MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL8534729 0.80 NSD2 (0.49) NSD2MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL634084 0.79 NSD2 (0.51) NSD2MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL30565211 0.78 CA1 (0.52) NSD2MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL3404809 0.78 NSD2 (0.69) NSD2MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL2893576 0.78 NSD2 (0.50) NSD2MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL264098 0.78 CA1 (0.52) NSD2MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL1111419 0.78 NSD2 (0.50) NSD2MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL3583413 0.78 NSD2 (0.50) NSD2MAPTSMN1; SMN2KDM4EMEN1

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-20230312616-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMA (US) 2023-10-05 US disclosed
US-20210139514-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED 2021-05-13 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 (2 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-20230312616-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR CFTR, SCNN1G, SCNN1B NSD2 4290/4885MAPT 4877/4885SMN1; SMN2 4797/4885
US-20210139514-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR CFTR, SCNN1G, SCNN1B NSD2 4290/4885MAPT 4877/4885SMN1; SMN2 4797/4885

“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.