SCHEMBL4177249

SCHEMBL4177249

CN(C)c1ccc(/C=C(/C#N)S(=O)(=O)Nc2ccc(F)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.49
PKM P14618 1/20 0.49
MPO P05164 1/20 0.48
MEN1 O00255 6/20 0.48
KMT2A Q03164 6/20 0.48
ALDH1A1 P00352 6/20 0.48
MAPT P10636 5/20 0.48
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA9 Q16790 2/20 0.47
CA12 O43570 1/20 0.47
RAB9A P51151 4/20 0.44
APP P05067 2/20 0.44
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.44
TP53 P04637 1/20 0.44
GAA P10253 1/20 0.44
SNCA P37840 1/20 0.44
BRCA1 P38398 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL4177251 1.00 L3MBTL1 (0.49) L3MBTL1PKMMPOMEN1KMT2A
SCHEMBL4177244 1.00 L3MBTL1 (0.49) L3MBTL1PKMMPOMEN1KMT2A
SCHEMBL4184760 0.88 MAPT (0.48) L3MBTL1MEN1KMT2AALDH1A1MAPT
SCHEMBL4184765 0.88 MAPT (0.48) L3MBTL1MEN1KMT2AALDH1A1MAPT
SCHEMBL4184769 0.88 MAPT (0.48) L3MBTL1MEN1KMT2AALDH1A1MAPT
SCHEMBL4169985 0.85 HPGD (0.52) PKMMEN1KMT2AALDH1A1MAPT
SCHEMBL4169991 0.85 HPGD (0.52) PKMMEN1KMT2AALDH1A1MAPT
SCHEMBL4169989 0.85 HPGD (0.52) PKMMEN1KMT2AALDH1A1MAPT
SCHEMBL4175095 0.83 PKM (0.52) L3MBTL1PKMKMT2AALDH1A1MAPT
SCHEMBL4191692 0.83 PKM (0.52) L3MBTL1PKMMEN1KMT2AALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090191193-A1 Aryl Vinyl Sulfides, Sulfones, Sulfoxides and Sulfonamides, Derivatives Thereof and Therapeutic Uses Thereof TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2009-07-30 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-20090191193-A1 Aryl Vinyl Sulfides, Sulfones, Sulfoxides and Sulfonamides, Derivatives Thereof and Therapeutic Uses Thereof ARSA, STS, SULT2A1 L3MBTL1 3476/4885PKM 2657/4885MPO 3187/4885

“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.