SCHEMBL6403536

SCHEMBL6403536

Cc1ccc(S(=O)(=O)N2c3ccccc3NC(=O)C2CC(=O)Nc2ccccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 1.00
POLB P06746 1/20 1.00
BDKRB1 P46663 11/20 0.75
KMT2A Q03164 2/20 0.47
MAPT P10636 3/20 0.47
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.47
RAB9A P51151 1/20 0.47
HSD17B10 Q99714 1/20 0.47
GAA P10253 2/20 0.45
GFER P55789 1/20 0.45
TP53 P04637 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL6029674 1.00 ALDH1A1 (1.00) ALDH1A1POLBBDKRB1KMT2AMAPT
SCHEMBL6407081 0.93 ALDH1A1 (0.86) ALDH1A1POLBBDKRB1KMT2AMAPT
SCHEMBL22563749 0.88 ALDH1A1 (0.77) ALDH1A1POLBBDKRB1MAPTGAA
SCHEMBL20457664 0.88 ALDH1A1 (0.77) ALDH1A1POLBBDKRB1MAPTGAA
SCHEMBL15599334 0.87 ALDH1A1 (0.77) ALDH1A1POLBBDKRB1KMT2AGAA
SCHEMBL4424964 0.86 ALDH1A1 (0.76) ALDH1A1POLBBDKRB1KMT2AMAPT
SCHEMBL4432052 0.86 ALDH1A1 (0.76) ALDH1A1POLBBDKRB1KMT2AMAPT
SCHEMBL4427205 0.85 BDKRB1 (0.78) ALDH1A1POLBBDKRB1KMT2AMAPT
SCHEMBL6404693 0.85 BDKRB1 (0.78) ALDH1A1POLBBDKRB1KMT2AMAPT
SCHEMBL6406344 0.85 POLB (0.73) ALDH1A1POLBBDKRB1KMT2AMAPT

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-20050020591-A1 2-Quinoxalinone derivatives as bradykinin antagonists and novel compounds SU DAI-SHI (US) 2005-01-27 US claimed
US-20050020591-A1 2-Quinoxalinone derivatives as bradykinin antagonists and novel compounds SU DAI-SHI (US) 2005-01-27 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-20050020591-A1 2-Quinoxalinone derivatives as bradykinin antagonists and novel compounds BDKRB1, BDKRB2, LTB4R2 ALDH1A1 3743/4885POLB 2903/4885BDKRB1 1/4885

“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.