SCHEMBL5625544

SCHEMBL5625544

Nc1ccc(C2CCCC2)cc1S(N)(=O)=S

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 2/20 0.41
HDAC2 Q92769 6/20 0.39
HDAC1 Q13547 6/20 0.39
BACE1 P56817 1/20 0.39
HDAC4 P56524 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
PTGES2 Q9H7Z7 2/20 0.38
HDAC3 O15379 1/20 0.37
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
CHRNA7 P36544 1/20 0.35
EPHX2 P34913 1/20 0.35
KMO O15229 1/20 0.34
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34

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
SCHEMBL1522466 0.85 PTGES2 (0.48) ACMSDHDAC2HDAC1BACE1HDAC4
SCHEMBL20093001 0.79 TYK2 (0.38) ACMSDHDAC2HDAC1BACE1HDAC3
SCHEMBL7952462 0.75 PTGS2 (0.51) ACMSDHDAC2HDAC1BACE1HDAC4
SCHEMBL20092262 0.75 HDAC1 (0.39) HDAC2HDAC1HDAC3
SCHEMBL14454641 0.75 HDAC1 (0.42) HDAC2HDAC1HDAC3
SCHEMBL15156130 0.73 BACE1 (0.49) ACMSDHDAC2HDAC1BACE1HDAC4
SCHEMBL3985023 0.71 BACE1 (0.51) ACMSDHDAC2HDAC1BACE1HDAC3
SCHEMBL30490281 0.71 HDAC1 (0.40) HDAC2HDAC1PTGES2HDAC3LMNA
SCHEMBL9297221 0.70 ACMSD (0.57) ACMSDHDAC2HDAC4HDAC8PTGES2
SCHEMBL25289702 0.70 HDAC1 (0.36) HDAC2HDAC1HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7235548-B2 Compounds and their use as positive AMPA receptor modulators NEUROSEARCH A/S (DK) 2007-06-26 US disclosed
US-6943159-B1 Compounds and their use as positive AMPA receptor modulators NEUROSEARCH A/S (DK) 2005-09-13 US disclosed
US-20040043987-A1 Novel compounds and their use as positive AMPA receptor modulators NEUROSEARCH A/S. 2004-03-04 US disclosed
EP-1071426-A2 NOVEL COMPOUNDS AND THEIR USE AS POSITIVE AMPA RECEPTOR MODULATORS NEUROSEARCH A/S (DK) 2001-01-31 EP disclosed
WO-1999042456-A2 NOVEL COMPOUNDS AND THEIR USE AS POSITIVE AMPA RECEPTOR MODULATORS NEUROSEARCH A/S (DK) 1999-08-26 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-20040043987-A1 Novel compounds and their use as positive AMPA receptor modulators GRIK4, GRIA4, GRM2 ACMSD 2885/4885HDAC2 703/4885HDAC1 1331/4885

“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.