SCHEMBL4185243

SCHEMBL4185243

COc1ccc(NS(=O)(=O)/C(C#N)=C\c2ccccc2OC)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.51
ALDH1A1 P00352 3/20 0.51
CA1 P00915 2/20 0.51
CA2 P00918 2/20 0.51
CA12 O43570 1/20 0.51
CA9 Q16790 1/20 0.51
KMT2A Q03164 6/20 0.50
LMNA P02545 3/20 0.50
PKM P14618 2/20 0.50
MEN1 O00255 5/20 0.47
CDK2 P24941 1/20 0.46
POLB P06746 2/20 0.44
MAOB P27338 1/20 0.43
MAPT P10636 4/20 0.43
HPGD P15428 2/20 0.43
GAA P10253 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
RECQL P46063 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL4185249 1.00 KDM4E (0.51) KDM4EALDH1A1CA1CA2CA12
SCHEMBL4185240 1.00 KDM4E (0.51) KDM4EALDH1A1CA1CA2CA12
SCHEMBL4191815 0.90 ALDH1A1 (0.51) KDM4EALDH1A1CA1CA2CA12
SCHEMBL4191817 0.90 ALDH1A1 (0.51) KDM4EALDH1A1CA1CA2CA12
SCHEMBL4191820 0.90 ALDH1A1 (0.51) KDM4EALDH1A1CA1CA2CA12
SCHEMBL4172497 0.90 MEN1 (0.52) KDM4EALDH1A1CA1CA2CA12
SCHEMBL4172485 0.90 MEN1 (0.52) KDM4EALDH1A1CA1CA2CA12
SCHEMBL4172491 0.90 MEN1 (0.52) KDM4EALDH1A1CA1CA2CA12
SCHEMBL4189421 0.89 KDM4E (0.50) KDM4EALDH1A1CA1CA2CA12
SCHEMBL4189424 0.89 KDM4E (0.50) KDM4EALDH1A1CA1CA2CA12

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 KDM4E 1688/4885ALDH1A1 249/4885CA1 3291/4885

“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.