SCHEMBL4646392

SCHEMBL4646392

CNC(=O)c1cccc(C#Cc2ccc(OC)c(S(=O)(=O)N[C@H](Cc3c[nH]c4ccccc34)C(C)(C)O)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 11/20 0.47
MMP2 P08253 9/20 0.47
NR3C1 P04150 2/20 0.44
PGR P06401 2/20 0.44
NR3C2 P08235 2/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ALOX5 P09917 1/20 0.41
EPHX2 P34913 1/20 0.41
HDAC8 Q9BY41 2/20 0.41
HDAC6 Q9UBN7 2/20 0.41
HDAC2 Q92769 1/20 0.41
KCNA5 P22460 1/20 0.41
GPR84 Q9NQS5 1/20 0.40

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
SCHEMBL4743144 0.98 MMP9 (0.47) MMP9MMP2NR3C1PGRNR3C2
SCHEMBL4646742 0.94 MMP9 (0.50) MMP9MMP2NR3C1PGRNR3C2
SCHEMBL14045666 0.90 MMP9 (0.50) MMP9MMP2NR3C1PGRNR3C2
SCHEMBL4646876 0.88 MMP9 (0.47) MMP9MMP2NR3C1PGRNR3C2
SCHEMBL14064775 0.88 NR3C1 (0.45) MMP9MMP2NR3C1PGRNR3C2
SCHEMBL14067205 0.88 KMT2A (0.45) MMP9MMP2NR3C1PGRNR3C2
SCHEMBL4743114 0.86 MMP9 (0.48) MMP9MMP2MEN1KMT2AALOX5
SCHEMBL14067206 0.84 KMT2A (0.46) MMP9MMP2NR3C1PGRNR3C2
SCHEMBL4688429 0.83 NR3C2 (0.48) MMP9MMP2NR3C1PGRNR3C2
SCHEMBL4648622 0.82 MMP9 (0.51) MMP9MMP2NR3C1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080255117-A1 SULFONYLTRYPTOPHANOLS BAYER SCHERING PHARMA AG (DE) 2008-10-16 US claimed
WO-2008104597-A2 SULFONYLTRYPTOPHANOLS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-09-04 WO claimed
EP-1964834-A1 Sulphonyltryptophanols Bayer Schering Pharma Aktiengesellschaft (DE) 2008-09-03 EP claimed
US-20080255117-A1 SULFONYLTRYPTOPHANOLS BAYER SCHERING PHARMA AG (DE) 2008-10-16 US disclosed
US-20080255117-A1 SULFONYLTRYPTOPHANOLS BAYER SCHERING PHARMA AG (DE) 2008-10-16 US disclosed
EP-1964834-A1 Sulphonyltryptophanols Bayer Schering Pharma Aktiengesellschaft (DE) 2008-09-03 EP 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-20080255117-A1 SULFONYLTRYPTOPHANOLS FSHR, NPY1R, GNRHR MMP9 4783/4885MMP2 4458/4885NR3C1 932/4885

“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.