SCHEMBL5445384

SCHEMBL5445384

NC(=O)c1ccccc1CS(=O)(=O)C[CH]C(=O)NC1=CCCCC1=O

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 3/20 0.35
FABP4 P15090 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 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
SCHEMBL5441976 0.75 KDM4E (0.34) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL5447008 0.72 TP53 (0.33) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL5441931 0.71 KDM4E (0.34) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL6738439 0.70 KDM4E (0.34) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL5438623 0.67 CTSK (0.38) KDM4EALDH1A1
SCHEMBL5443363 0.67 CTSK (0.38) KDM4EALDH1A1
SCHEMBL5438721 0.67 CTSK (0.38) KDM4EALDH1A1
SCHEMBL6697355 0.67
SCHEMBL5440671 0.66 MMP1 (0.36) KDM4EALDH1A1
SCHEMBL5440806 0.66 PARP1 (0.35) ALDH1A1

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-20070135386-A1 Novel Compounds and Compositions as Cathepsin Inhibitors AVENTIS PHARMACEUTICALS INC. (US) 2007-06-14 US claimed
US-20070135386-A1 Novel Compounds and Compositions as Cathepsin Inhibitors AVENTIS PHARMACEUTICALS INC. (US) 2007-06-14 US disclosed
US-7196099-B2 Compounds and compositions as cathepsin inhibitors AVENTIS PHARMACEUTICALS INC. (US) 2007-03-27 US 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-20070135386-A1 Novel Compounds and Compositions as Cathepsin Inhibitors CTSS, CTSB, CTSE KDM4E 4317/4885ALDH1A1 3814/4885FABP4 2654/4885

“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.