SCHEMBL3898192

SCHEMBL3898192

Cc1ccc(S(=O)(=O)NCCCN(CCCNS(=O)(=O)c2ccc(C)cc2)S(=O)(=O)c2ccc(C)cc2)cc1.[NaH].[NaH]

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.70
CA2 P00918 1/20 0.70
CA9 Q16790 1/20 0.70
ALOX15 P16050 1/20 0.68
ALDH1A1 P00352 14/20 0.61
HTT P42858 2/20 0.57
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
MBTD1 Q05BQ5 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
LMNA P02545 3/20 0.52
NPSR1 Q6W5P4 1/20 0.52
HPGD P15428 1/20 0.49

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
SCHEMBL3905679 0.98 CA12 (0.72) CA12CA2CA9ALOX15ALDH1A1
SCHEMBL7203889 0.97 CA12 (0.70) CA12CA2CA9ALOX15ALDH1A1
SCHEMBL472226 0.97 CA12 (0.70) CA12CA2CA9ALOX15ALDH1A1
SCHEMBL7095475 0.95 CA12 (0.68) CA12CA2CA9ALOX15ALDH1A1
SCHEMBL7095728 0.94 CA12 (0.66) CA12CA2CA9ALOX15ALDH1A1
SCHEMBL7203875 0.93 CA12 (0.64) CA12CA2CA9ALOX15ALDH1A1
SCHEMBL7097556 0.93 CA12 (0.64) CA12CA2CA9ALOX15ALDH1A1
SCHEMBL7207746 0.93 CA12 (0.64) CA12CA2CA9ALOX15ALDH1A1
SCHEMBL7205364 0.93 CA12 (0.64) CA12CA2CA9ALOX15ALDH1A1
SCHEMBL7097820 0.93 CA12 (0.64) CA12CA2CA9ALOX15ALDH1A1

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-7557205-B2 For improving contrast of X-ray, ultrasound, radionuclide and magnetic resonance images THE HONG KONG POLYTECHNIC UNIVERSITY (CN) 2009-07-07 US disclosed
US-20060069249-A1 For improving contrast of X-ray, ultrasound, radionuclide and magnetic resonance images HONG KONG POLYTECHNIC UNIVERSITY (CN) 2006-03-30 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-20060069249-A1 For improving contrast of X-ray, ultrasound, radionuclide and magnetic resonance images SON, SPIN3, SHROOM3 CA12 2015/4885CA2 3287/4885CA9 2308/4885

“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.