SCHEMBL3905129

SCHEMBL3905129

COC(=O)C(NS(=O)(=O)c1ccc(Cl)cc1)C(CC(F)(F)F)CC(F)(F)F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 4/20 0.48
▸ MMP1 P03956 2/20 0.48
▸ MMP3 P08254 2/20 0.48
▸ MMP7 P09237 2/20 0.48
▸ MMP9 P14780 2/20 0.48
▸ MMP13 P45452 2/20 0.48
▸ SLC1A3 P43003 1/20 0.47
▸ SLC1A2 P43004 1/20 0.47
▸ SLC1A1 P43005 1/20 0.47
▸ LMNA P02545 2/20 0.44
▸ NPSR1 Q6W5P4 2/20 0.44
▸ CA2 P00918 2/20 0.42
▸ CA12 O43570 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ CA14 Q9ULX7 1/20 0.42
▸ EEF2K O00418 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41

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
SCHEMBL3907807 1.00 MMP2 (0.48) MMP2MMP1MMP3MMP7MMP9
SCHEMBL3904754 0.83 MMP2 (0.51) MMP2MMP1MMP3MMP7MMP9
SCHEMBL2888169 0.81 PSEN1 (0.52) MMP2MMP9LMNAALDH1A1CYP1A2
SCHEMBL2888168 0.81 PSEN1 (0.52) MMP2MMP9LMNAALDH1A1CYP1A2
SCHEMBL3187445 0.78 MMP2 (0.54) MMP2MMP1MMP3MMP7MMP9
SCHEMBL3906847 0.76 PSEN1 (0.46) MMP2MMP1MMP3MMP7MMP9
SCHEMBL3904719 0.76 PSEN1 (0.46) MMP2MMP1MMP3MMP7MMP9
SCHEMBL3904762 0.74 MMP2 (0.50) MMP2MMP1MMP3MMP7MMP9
SCHEMBL3906115 0.74 MMP2 (0.50) MMP2MMP1MMP3MMP7MMP9
SCHEMBL10076123 0.73 MMP2 (0.50) MMP2MMP1MMP3MMP7MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090221711-A1 TRIFLUOROMETHYL-CONTAINING PHENYLSULFONAMIDE BETA AMYLOID INHIBITORS WYETH (US) 2009-09-03 — — US disclosed
US-7550629-B2 4-chloro-N-[(1S)-3,3,3-trifluoro-1-(hydroxymethyl)-2-(trifluoromethyl)propyl]benzenesulfonamide; 4-cyano-N-(3,3,3-trifluoro-1-hydroxymethyl-2-trifluoromethyl-propyl)-benzenesulfonamide; Alzheimer's Disease, amyloid angiopathy, systemic amyloidosis, mild cognitive impairment and Down's syndrome WYETH (US) 2009-06-23 — — US disclosed
US-20090082591-A1 METHODS FOR PREPARING SULFONAMIDE COMPOUNDS WYETH (US) 2009-03-26 — — US disclosed
US-20090082591-A1 METHODS FOR PREPARING SULFONAMIDE COMPOUNDS WYETH (US) 2009-03-26 — — US disclosed
US-7476762-B2 Methods for preparing sulfonamide compounds WYETH (US) 2009-01-13 — — US disclosed
US-7476762-B2 Methods for preparing sulfonamide compounds WYETH (US) 2009-01-13 — — US disclosed
US-20070249723-A1 Methods for preparing sulfonamide compounds WYETH (US) 2007-10-25 — — US disclosed
US-20070249722-A1 Trifluoromethyl-containing phenylsulfonamide beta amyloid inhibitors WYETH (US) 2007-10-25 — — US disclosed
US-20070249723-A1 Methods for preparing sulfonamide compounds WYETH (US) 2007-10-25 — — 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 (4 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-20090221711-A1 TRIFLUOROMETHYL-CONTAINING PHENYLSULFONAMIDE BETA AMYLOID INHIBITORS APP, PSEN1, BACE1 MMP2 1636/4885MMP1 298/4885MMP3 1594/4885
US-20070249722-A1 Trifluoromethyl-containing phenylsulfonamide beta amyloid inhibitors APP, PSEN1, BACE1 MMP2 1636/4885MMP1 298/4885MMP3 1594/4885
US-20070249723-A1 Methods for preparing sulfonamide compounds PNISR, RRM1, MRPS27 MMP2 4403/4885MMP1 4650/4885MMP3 3238/4885
US-20090082591-A1 METHODS FOR PREPARING SULFONAMIDE COMPOUNDS PNISR, RRM1, MRPS27 MMP2 4403/4885MMP1 4650/4885MMP3 3238/4885

“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.

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