SCHEMBL4171795

SCHEMBL4171795

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.41
KDM4E B2RXH2 2/20 0.40
EGFR P00533 1/20 0.40
HPGD P15428 4/20 0.39
PKM P14618 2/20 0.39
PTGES2 Q9H7Z7 1/20 0.39
MEN1 O00255 4/20 0.38
RAB9A P51151 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
POLB P06746 2/20 0.38
LMNA P02545 1/20 0.38
THRB P10828 1/20 0.38
MAPT P10636 3/20 0.38
FKBP1A P62942 1/20 0.38
NPC1 O15118 1/20 0.38
FFAR4 Q5NUL3 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
CYP2D6 P10635 1/20 0.37
NPSR1 Q6W5P4 2/20 0.37
JAK2 O60674 1/20 0.37

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
SCHEMBL4171800 1.00 KMT2A (0.41) KMT2AKDM4EEGFRHPGDPKM
SCHEMBL4171803 1.00 KMT2A (0.41) KMT2AKDM4EEGFRHPGDPKM
SCHEMBL4188578 0.88 CYTH2 (0.44) KMT2AKDM4EEGFRHPGDPKM
SCHEMBL4188580 0.88 CYTH2 (0.44) KMT2AKDM4EEGFRHPGDPKM
SCHEMBL4188573 0.88 CYTH2 (0.44) KMT2AKDM4EEGFRHPGDPKM
SCHEMBL4168404 0.87 L3MBTL1 (0.43) KMT2AKDM4EEGFRHPGDPKM
SCHEMBL4168400 0.87 L3MBTL1 (0.43) KMT2AKDM4EEGFRHPGDPKM
SCHEMBL4168406 0.87 L3MBTL1 (0.43) KMT2AKDM4EEGFRHPGDPKM
SCHEMBL4185860 0.87 PTGES2 (0.41) KMT2AKDM4EEGFRHPGDPKM
SCHEMBL4185856 0.87 PTGES2 (0.41) KMT2AKDM4EEGFRHPGDPKM

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 KMT2A 469/4885KDM4E 1688/4885EGFR 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.