SCHEMBL6740192

SCHEMBL6740192

O=C(NO)[C@H](NS(=O)(=O)Cc1ccc2sc(F)cc2c1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 6/20 0.39
MEP1B Q16820 2/20 0.39
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
ANPEP P15144 1/20 0.36

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
SCHEMBL6740196 1.00 HDAC1 (0.39) HDAC1MEP1BHDAC8HDAC6ANPEP
SCHEMBL7467263 0.90 SLC1A3 (0.38) HDAC1
SCHEMBL6738953 0.83 MEP1B (0.41) HDAC1MEP1BHDAC8HDAC6
SCHEMBL6738949 0.83 MEP1B (0.41) HDAC1MEP1BHDAC8HDAC6
SCHEMBL6738793 0.82 MEP1B (0.45) HDAC1MEP1BHDAC8HDAC6
SCHEMBL6738796 0.82 MEP1B (0.45) HDAC1MEP1BHDAC8HDAC6
SCHEMBL6734421 0.81 MEP1B (0.39) MEP1BHDAC8HDAC6ANPEP
SCHEMBL6734419 0.81 MEP1B (0.39) MEP1BHDAC8HDAC6ANPEP
SCHEMBL6743310 0.79 MEP1B (0.41) HDAC1MEP1BHDAC8HDAC6
SCHEMBL7061042 0.79 MEP1B (0.41) HDAC1MEP1BHDAC8HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040225006-A1 (Hetero) bicyclymethanesulfonylamino-substituted hydroxamic acid derivates SMITHKLINE BEECHAM P.L.C. 2004-11-11 US disclosed
US-20030199571-A1 (Hetero) Bicyclymethanesulfonylamino-substituted hydroxamic acid derivatives SMITHKLINE BEECHAM P.L.C. (GB) 2003-10-23 US disclosed
EP-1244616-A1 (HETERO)BICYCLYLMETHANESULFONYLAMINO-SUBSTITUTED HYDROXAMIC ACID DERIVATIVES SmithKline Beecham plc (GB) 2002-10-02 EP disclosed
WO-2001047874-A1 (HETERO)BICYCLYMETHANESULFONYLAMINO-SUBSTITUTED HYDROXAMIC ACID DERIVATIVES SMITHKLINE BEECHAM P.L.C. (GB) 2001-07-05 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 (2 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-20030199571-A1 (Hetero) Bicyclymethanesulfonylamino-substituted hydroxamic acid derivatives CD40, CD22, CD2 HDAC1 268/4885MEP1B 515/4885HDAC8 1721/4885
US-20040225006-A1 (Hetero) bicyclymethanesulfonylamino-substituted hydroxamic acid derivates CD40, TNFRSF1A, CD2 HDAC1 209/4885MEP1B 484/4885HDAC8 2151/4885

“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.