SCHEMBL3532180

SCHEMBL3532180

Cc1ccc(S(=O)(=O)N2C=CN(C)C(=O)[C@H]2CC(=O)N[C@@H]2CCCc3ccccc32)cc1

nearest known ligand 0.75

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 18/20 0.75
ALDH1A1 P00352 2/20 0.57
MEN1 O00255 1/20 0.52
LMNA P02545 1/20 0.52
KMT2A Q03164 1/20 0.52

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
SCHEMBL3538815 0.85 BDKRB1 (1.00) BDKRB1
SCHEMBL3532655 0.84 BDKRB1 (0.78) BDKRB1
SCHEMBL3532659 0.84 BDKRB1 (0.78) BDKRB1
SCHEMBL3541706 0.80 BDKRB1 (1.00) BDKRB1
SCHEMBL3533642 0.80 BDKRB1 (1.00) BDKRB1
SCHEMBL3538124 0.78 BDKRB1 (0.87) BDKRB1
SCHEMBL5519309 0.76 BDKRB1 (0.53) BDKRB1ALDH1A1MEN1LMNAKMT2A
SCHEMBL3535825 0.74 BDKRB1 (0.80) BDKRB1
SCHEMBL13499172 0.74 BDKRB1 (0.80) BDKRB1
SCHEMBL3534752 0.74 BDKRB1 (0.87) BDKRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7662811-B2 N-(((5R)-5-((1-methylethyl)amino)-5,6,7,8-tetrahydro-2-naphthalenyl)methyl)-2-((2R)-1-((4-methylphenyl)sulfonyl)-3-oxo-1,2,3,4-tetrahydro-2-pyrazinyl)acetamide; for treatment of pain and diseases, such as inflammation mediated diseases AMGEN INC. (US) 2010-02-16 US claimed
US-20060025400-A1 1,2,3,4-Tetrahydropyrazin-2-yl acetamides and methods of use AMGEN INC. 2006-02-02 US claimed

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-20060025400-A1 1,2,3,4-Tetrahydropyrazin-2-yl acetamides and methods of use AADAC, PTGES2, LTC4S BDKRB1 386/4885ALDH1A1 158/4885MEN1 4335/4885

“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.