SCHEMBL4937409

SCHEMBL4937409

[CH2]S(=O)(=O)Cc1ncoc1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK2 P53671 1/20 0.47
ADORA2A P29274 1/20 0.44
FBP1 P09467 1/20 0.39
SCN9A Q15858 1/20 0.36
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32
GSK3B P49841 1/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA5A P35218 2/20 0.32
CA9 Q16790 2/20 0.32

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
SCHEMBL4937416 0.84 LIMK2 (0.47) LIMK2ADORA2AFBP1SCN9AHCRTR1
SCHEMBL3075748 0.74 ADORA2A (0.50) LIMK2ADORA2AFBP1HCRTR1HCRTR2
SCHEMBL14391718 0.74 ADORA2A (0.46) LIMK2ADORA2AFBP1HCRTR1HCRTR2
SCHEMBL2413968 0.74 ADORA2A (0.46) LIMK2ADORA2AFBP1SCN9AHCRTR1
SCHEMBL244662 0.74 ADORA2A (0.46) LIMK2ADORA2AFBP1SCN9AHCRTR1
SCHEMBL4980427 0.74 LIMK2 (0.42) LIMK2ADORA2AFBP1SCN9AHCRTR1
SCHEMBL8334922 0.71 ADORA2A (0.44) LIMK2ADORA2AFBP1HCRTR1HCRTR2
SCHEMBL12867188 0.70 ADORA2A (0.42) LIMK2ADORA2AFBP1HCRTR1HCRTR2
SCHEMBL6050930 0.70 LIMK2 (0.44) LIMK2ADORA2AFBP1SCN9AHCRTR1
SCHEMBL1272623 0.69 PTGS2 (0.44) ALDH1A1MEN1KMT2AHSD17B10LMNA

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
EP-1866277-B1 SULFONYL CONTAINING COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS VIROBAY INC (US) 2014-06-25 EP disclosed
US-20080287446-A1 Sulfonyl Containing Compounds as Cysteine Protease Inhibitors QUEST DIAGNOSTICS INVESTMENTS LLC 2008-11-20 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-20080287446-A1 Sulfonyl Containing Compounds as Cysteine Protease Inhibitors CTSS, CTSF, CTSB LIMK2 3965/4885ADORA2A 4211/4885FBP1 393/4885

“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.