SCHEMBL4966967

SCHEMBL4966967

CS(=O)(=O)c1ccc(C(=O)Nc2nc3c(s2)=CC2=CC=CCC=32)s1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.37
RAB9A P51151 9/20 0.37
SMN1; SMN2 Q16637 6/20 0.37
TP53 P04637 4/20 0.37
ALDH1A1 P00352 4/20 0.37
KDM4E B2RXH2 4/20 0.37
NPSR1 Q6W5P4 2/20 0.37
TSHR P16473 1/20 0.37
KMT2A Q03164 10/20 0.32
MEN1 O00255 9/20 0.32
LMNA P02545 3/20 0.32
PKM P14618 1/20 0.32
HPGD P15428 4/20 0.32
HSD17B10 Q99714 1/20 0.32
CASP3 P42574 3/20 0.31
SENP8 Q96LD8 3/20 0.31
SENP7 Q9BQF6 3/20 0.31
SENP6 Q9GZR1 3/20 0.31
NFKB1 P19838 2/20 0.31
HTT P42858 2/20 0.31

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
SCHEMBL1822990 0.79 NPC1 (0.47) NPC1RAB9ASMN1; SMN2TP53ALDH1A1
SCHEMBL1819297 0.69 KDM1A (0.35) NPC1RAB9ASMN1; SMN2ALDH1A1NPSR1
SCHEMBL3340590 0.65 MAPT (0.46) NPC1RAB9ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL3340846 0.65 GAA (0.39) NPC1RAB9ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL4960018 0.64
Iodide SCHEMBL3991507 0.62
Fumaric Acid SCHEMBL9048088 0.60
Fumaric Acid SCHEMBL9045625 0.59
Fumaric Acid SCHEMBL9047183 0.59 ALDH1A1 (0.30) ALDH1A1
SCHEMBL8628158 0.58 NPSR1 (0.42) NPC1RAB9ASMN1; SMN2TP53ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7407977-B2 Substituted N-acyl-2-aminothiazoles HOFFMAN-LA ROCHE INC. (US) 2008-08-05 US claimed
EP-1791822-A1 SUBSTITUTED N-ACYL-2-AMINOTHIAZOLES F.HOFFMANN-LA ROCHE AG (CH) 2007-06-06 EP claimed
US-20060030589-A1 Substituted N-acyl-2-aminothiazoles HOFFMANN-LA ROCHE INC. 2006-02-09 US claimed
WO-2006013054-A1 SUBSTITUTED N-ACYL-2-AMINOTHIAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2006-02-09 WO claimed
US-7407977-B2 Substituted N-acyl-2-aminothiazoles HOFFMAN-LA ROCHE INC. (US) 2008-08-05 US disclosed
EP-1791822-A1 SUBSTITUTED N-ACYL-2-AMINOTHIAZOLES F.HOFFMANN-LA ROCHE AG (CH) 2007-06-06 EP disclosed
US-20060030589-A1 Substituted N-acyl-2-aminothiazoles HOFFMANN-LA ROCHE INC. 2006-02-09 US disclosed
WO-2006013054-A1 SUBSTITUTED N-ACYL-2-AMINOTHIAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2006-02-09 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-20060030589-A1 Substituted N-acyl-2-aminothiazoles SLC5A2, ABAT, AGTR2 NPC1 1402/4885RAB9A 1576/4885SMN1; SMN2 646/4885

“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.