SCHEMBL4189433

SCHEMBL4189433

COc1cc(OC)c(OC)cc1C=C(C#N)S(=O)(=O)Nc1ccc(C)cc1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
FFAR4 Q5NUL3 1/20 0.43
HPGD P15428 3/20 0.41
MAPT P10636 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
SMN1; SMN2 Q16637 5/20 0.39
MEN1 O00255 3/20 0.39
LMNA P02545 3/20 0.39
GAA P10253 1/20 0.39
PKM P14618 3/20 0.37
CYP2D6 P10635 1/20 0.37
L3MBTL1 Q9Y468 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
SCHEMBL4189427 1.00 KMT2A (0.44) KMT2ACA12CA1CA2CA9
SCHEMBL4189431 1.00 KMT2A (0.44) KMT2ACA12CA1CA2CA9
SCHEMBL4177173 0.88 KMT2A (0.45) KMT2ACA12CA1CA2CA9
SCHEMBL4177177 0.88 KMT2A (0.45) KMT2ACA12CA1CA2CA9
SCHEMBL4177179 0.88 KMT2A (0.45) KMT2ACA12CA1CA2CA9
SCHEMBL4177165 0.86 FFAR4 (0.48) KMT2ACA12CA1CA2CA9
SCHEMBL4177161 0.86 FFAR4 (0.48) KMT2ACA12CA1CA2CA9
SCHEMBL4177156 0.86 FFAR4 (0.48) KMT2ACA12CA1CA2CA9
SCHEMBL4172368 0.86 KMT2A (0.44) KMT2AFFAR4HPGDMAPTCYP3A4
SCHEMBL4172358 0.86 KMT2A (0.44) KMT2AFFAR4HPGDMAPTCYP3A4

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 KMT2A 469/4885CA12 2120/4885CA1 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.