SCHEMBL6407052

SCHEMBL6407052

CC(C)(C)OC(=O)N(CCCc1ccccc1)COS(C)(=O)=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
NCOR2 Q9Y618 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
RCE1 Q9Y256 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA7 P43166 1/20 0.40
CA14 Q9ULX7 1/20 0.40
ALOX5 P09917 1/20 0.39
AKT1 P31749 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
KMT2A Q03164 1/20 0.38
STAT5B P51692 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL25048209 0.85 RCE1 (0.44) HDAC3HDAC1HDAC2NCOR2L3MBTL1
SCHEMBL2797220 0.82 HDAC3 (0.47) HDAC3HDAC1HDAC2NCOR2L3MBTL1
SCHEMBL6400630 0.81 L3MBTL1 (0.47) HDAC3HDAC1HDAC2NCOR2L3MBTL1
SCHEMBL6403266 0.81 L3MBTL1 (0.43) HDAC3HDAC1HDAC2NCOR2L3MBTL1
SCHEMBL7983925 0.80 L3MBTL1 (0.46) HDAC3HDAC1HDAC2NCOR2L3MBTL1
SCHEMBL1844315 0.80 L3MBTL1 (0.46) HDAC3HDAC1HDAC2NCOR2L3MBTL1
SCHEMBL7971622 0.79 MC5R (0.46) HDAC3HDAC1HDAC2NCOR2L3MBTL1
SCHEMBL7983626 0.79 L3MBTL1 (0.48) HDAC3HDAC1HDAC2NCOR2L3MBTL1
SCHEMBL1799805 0.79 HDAC1 (0.51) HDAC3HDAC1HDAC2NCOR2L3MBTL1
SCHEMBL4289433 0.78 L3MBTL1 (0.44) HDAC3HDAC1HDAC2NCOR2L3MBTL1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6900237-B2 Sulfonamide compounds as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2005-05-31 US disclosed
US-20030158231-A1 Sulfonamide compounds as protease inhibitors Celera Corporation 2003-08-21 US disclosed
WO-2003024923-A1 SULFONAMIDE COMPOUNDS AS PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2003-03-27 WO 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-20030158231-A1 Sulfonamide compounds as protease inhibitors PRSS1, PRSS3, SPINT2 HDAC3 434/4885HDAC1 538/4885HDAC2 502/4885

“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.