SCHEMBL4179898

SCHEMBL4179898

N#C/C(=C\c1ccc(F)cc1F)S(=O)(=O)Cc1ccc(Br)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.51
PPME1 Q9Y570 1/20 0.39
EGFR P00533 3/20 0.39
ERBB2 P04626 2/20 0.39
NLRP3 Q96P20 1/20 0.37
POLB P06746 3/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
CTDSP1 Q9GZU7 2/20 0.35
ALDH1A1 P00352 2/20 0.35
GRK2 P25098 1/20 0.35
PKM P14618 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
TSHR P16473 1/20 0.33
MAPT P10636 1/20 0.33
PTGES2 Q9H7Z7 2/20 0.33

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
SCHEMBL4179906 1.00 LMNA (0.51) LMNAPPME1EGFRERBB2NLRP3
SCHEMBL4179908 1.00 LMNA (0.51) LMNAPPME1EGFRERBB2NLRP3
SCHEMBL4183775 0.89 LMNA (0.58) LMNAPPME1EGFRERBB2POLB
SCHEMBL4183778 0.89 LMNA (0.58) LMNAPPME1EGFRERBB2POLB
SCHEMBL4183780 0.89 LMNA (0.58) LMNAPPME1EGFRERBB2POLB
SCHEMBL4169998 0.88 LMNA (0.39) LMNAPPME1EGFRERBB2NLRP3
SCHEMBL4169994 0.88 LMNA (0.39) LMNAPPME1EGFRERBB2NLRP3
SCHEMBL4169999 0.88 LMNA (0.39) LMNAPPME1EGFRERBB2NLRP3
SCHEMBL4191978 0.85 LMNA (0.48) LMNAEGFRERBB2POLBALDH1A1
SCHEMBL4191974 0.85 LMNA (0.48) LMNAEGFRERBB2POLBALDH1A1

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 LMNA 4621/4885PPME1 2181/4885EGFR 66/4885

“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.