SCHEMBL4168404

SCHEMBL4168404

Cc1ccc(NS(=O)(=O)/C(C#N)=C\c2ccc(Cl)c(Cl)c2)c(C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.43
PTGES2 Q9H7Z7 1/20 0.42
KMT2A Q03164 5/20 0.40
PKM P14618 3/20 0.40
POLB P06746 3/20 0.40
HPGD P15428 2/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 4/20 0.39
MEN1 O00255 3/20 0.39
MAPT P10636 3/20 0.39
LMNA P02545 2/20 0.39
HTT P42858 1/20 0.39
ATM Q13315 1/20 0.39
GPR35 Q9HC97 1/20 0.39
KDM4E B2RXH2 2/20 0.38
EGFR P00533 1/20 0.38
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
TAS1R2 Q8TE23 1/20 0.38
RAB9A P51151 2/20 0.36

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
SCHEMBL4168406 1.00 L3MBTL1 (0.43) L3MBTL1PTGES2KMT2APKMPOLB
SCHEMBL4168400 1.00 L3MBTL1 (0.43) L3MBTL1PTGES2KMT2APKMPOLB
SCHEMBL4179117 0.88 PTGES2 (0.54) L3MBTL1PTGES2KMT2APKMPOLB
SCHEMBL4179125 0.88 PTGES2 (0.54) L3MBTL1PTGES2KMT2APKMPOLB
SCHEMBL4179123 0.88 PTGES2 (0.54) L3MBTL1PTGES2KMT2APKMPOLB
SCHEMBL4171800 0.87 KMT2A (0.41) L3MBTL1PTGES2KMT2APKMPOLB
SCHEMBL4171803 0.87 KMT2A (0.41) L3MBTL1PTGES2KMT2APKMPOLB
SCHEMBL4171795 0.87 KMT2A (0.41) L3MBTL1PTGES2KMT2APKMPOLB
SCHEMBL4188573 0.85 CYTH2 (0.44) L3MBTL1PTGES2KMT2APKMPOLB
SCHEMBL4188578 0.85 CYTH2 (0.44) L3MBTL1PTGES2KMT2APKMPOLB

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-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 claimed
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 3476/4885PTGES2 1556/4885KMT2A 469/4885

“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.