SCHEMBL7121669

SCHEMBL7121669

COc1ccc(S(=O)(=O)NC(CCc2ccccc2)C(=O)NC(C)(C)C)cc1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.63
POLB P06746 2/20 0.63
MMP2 P08253 7/20 0.55
MMP9 P14780 5/20 0.55
BMP1 P13497 5/20 0.54
MMP3 P08254 6/20 0.53
MMP1 P03956 4/20 0.53
MMP13 P45452 4/20 0.53
PDE4A P27815 1/20 0.51
PDE4B Q07343 1/20 0.51
PDE4C Q08493 1/20 0.51
PDE4D Q08499 1/20 0.51
PLAU P00749 1/20 0.50
HPN P05981 1/20 0.50
MMP8 P22894 1/20 0.48

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
SCHEMBL7124459 0.90 ALDH1A1 (0.57) ALDH1A1POLBMMP2MMP9MMP1
SCHEMBL7127817 0.88 MMP2 (0.53) ALDH1A1POLBMMP2MMP9PLAU
SCHEMBL7127019 0.85 PLAU (0.60) ALDH1A1MMP2MMP9PLAUHPN
SCHEMBL7124501 0.84 PLAU (0.54) ALDH1A1MMP2MMP9MMP3PLAU
SCHEMBL7125293 0.84 PLAU (0.59) ALDH1A1POLBMMP2MMP9MMP1
SCHEMBL7118405 0.84 MMP2 (0.50) ALDH1A1MMP2MMP9MMP3MMP1
SCHEMBL7117861 0.79 PSMB8 (0.54) ALDH1A1MMP2MMP9MMP1PLAU
SCHEMBL7127030 0.79 PSMB8 (0.51) ALDH1A1MMP2MMP9MMP3MMP1
SCHEMBL7126168 0.78 MMP2 (0.49) ALDH1A1POLBMMP2MMP9MMP1
SCHEMBL7118677 0.78 MMP2 (0.49) ALDH1A1MMP2MMP9BMP1PLAU

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-6583318-B2 Carrying out a four component condensation reaction between components consisting of a sulfonamide, an aldehyde or ketone, an isocyanide and a carboxylic acid, and one of such components being attached to a solid support ADVANCED SYNTECH, LLC 2003-06-24 US disclosed
US-20030013910-A1 Method for synthesis of alpha-sulfonamido amide, carboxylic acid and hydroxamic acid derivatives ADVANCED SYNTECH LLC 2003-01-16 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-20030013910-A1 Method for synthesis of alpha-sulfonamido amide, carboxylic acid and hydroxamic acid derivatives ASPH, COASY, HAAO ALDH1A1 391/4885POLB 1804/4885MMP2 2100/4885

“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.