SCHEMBL1655663

SCHEMBL1655663

CC1(C)OB(c2ccc(OCc3cc4ccccc4o3)cc2)OC1(C)C

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LPL P06858 3/20 0.49
LIPG Q9Y5X9 3/20 0.49
AGXT P21549 1/20 0.47
DGAT1 O75907 1/20 0.46
ADAMTS4 O75173 1/20 0.43
HTR1A P08908 4/20 0.42
HTR2B P41595 4/20 0.42
DRD2 P14416 2/20 0.42
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
LOXL2 Q9Y4K0 1/20 0.40
SNCA P37840 1/20 0.39

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
SCHEMBL3612793 0.82 SLC6A4 (0.43) LPLLIPGAGXTHTR1AHTR2B
SCHEMBL1656907 0.78 LPL (0.59) LPLLIPGDGAT1CA1CA2
SCHEMBL16382817 0.76 LPL (0.50) LPLLIPGDGAT1CA1CA2
SCHEMBL13960026 0.76 KMT2A (0.57) AGXTADAMTS4HTR1AHTR2BDRD2
SCHEMBL298401 0.76 DGAT1 (0.72) LPLLIPGDGAT1CA1CA2
SCHEMBL120103 0.74 AGXT (0.55) AGXTADAMTS4HTR1AHTR2BDRD2
SCHEMBL1656882 0.74 DGAT1 (0.46) LPLLIPGDGAT1ADAMTS4CA1
SCHEMBL29631757 0.73 LIPG (0.60) LPLLIPGCA1CA2CA9
SCHEMBL119892 0.73 AGXT (0.54) AGXTADAMTS4HTR1AHTR2BDRD2
SCHEMBL15481259 0.73 LIPG (0.60) LPLLIPGCA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7923446-B2 3-Methyl-2-[4'-(pyridin-3-ylmethoxymethyl)-biphenyl-4-sulfonylamino]-butyric acid; metalloproteinase inhibitors; arthritis, macular degeneration, graft versus host disease, cancer, osteoarthritis WYETH LLC (US) 2011-04-12 US disclosed
US-20100137298-A1 Biaryl Sulfonamides and Methods for Using Same WYETH (US) 2010-06-03 US disclosed
EP-1689380-A4 METHOD FOR TREATING ADAMTS-5-ASSOCIATED DISEASE WYETH CORP (US) 2009-03-18 EP disclosed
US-20080311113-A1 METHOD FOR TREATING ADAMTS-5-ASSOCIATED DISEASE WYETH (US) 2008-12-18 US disclosed
EP-1692124-B1 BIARYL SULFONAMIDES AS MMP INHIBITORS WYETH CORP (US) 2008-10-15 EP disclosed
US-7420001-B2 Biaryl sulfonamides and methods for using same WYETH (US) 2008-09-02 US disclosed
US-7390833-B2 Method for treating ADAMTS-5-associated disease WYETH (US) 2008-06-24 US disclosed
US-20070225327-A1 Biaryl Sulfonamides and Methods for Using Same WYETH (US) 2007-09-27 US disclosed
US-7268135-B2 Biaryl sulfonamides and methods for using same WYETH (US) 2007-09-11 US disclosed
EP-1692124-A1 BIARYL SULFONAMIDES AS MMP INHIBITORS Wyeth (US) 2006-08-23 EP disclosed
EP-1689380-A2 METHOD FOR TREATING ADAMTS-5-ASSOCIATED DISEASE Wyeth (US) 2006-08-16 EP disclosed
EP-1689716-A1 BIARYL SULFONAMIDES AND METHODS FOR USING SAME Wyeth (US) 2006-08-16 EP disclosed
US-20060004066-A1 Method for treating ADAMTS-5-associated disease WYETH (US) 2006-01-05 US disclosed
WO-2005061477-A1 BIARYL SULFONAMIDES AS MMP INHIBITORS WYETH (US) 2005-07-07 WO disclosed
WO-2005060456-A2 METHOD FOR TREATING ADAMTS-5-ASSOCIATE DISEASE WYETH (US) 2005-07-07 WO disclosed
WO-2005061459-A1 BIARYL SULFONAMIDES AND METHODS FOR USING SAME WYETH (US) 2005-07-07 WO disclosed
US-20050143422-A1 Biaryl sulfonamides and methods for using same WYETH (US) 2005-06-30 US disclosed
US-20050130973-A1 Biaryl sulfonamides and methods for using same WYETH (US) 2005-06-16 US disclosed
CN-1623537-A Biaryl sulfonamides and its using method WYETH CORP (US) 2005-06-08 CN 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 (6 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-20050130973-A1 Biaryl sulfonamides and methods for using same STS, MMP3, AADAC LPL 885/4885LIPG 862/4885AGXT 210/4885
US-20060004066-A1 Method for treating ADAMTS-5-associated disease ADAMTS5, ADAMTS1, ADAMTS4 LPL 1302/4885LIPG 1566/4885AGXT 57/4885
US-20100137298-A1 Biaryl Sulfonamides and Methods for Using Same STS, MMP3, AADAC LPL 885/4885LIPG 862/4885AGXT 210/4885
US-20050143422-A1 Biaryl sulfonamides and methods for using same STS, MMP3, AADAC LPL 885/4885LIPG 862/4885AGXT 210/4885
US-20080311113-A1 METHOD FOR TREATING ADAMTS-5-ASSOCIATED DISEASE ADAMTS5, ADAMTS1, ADAMTS4 LPL 1302/4885LIPG 1566/4885AGXT 57/4885
US-20070225327-A1 Biaryl Sulfonamides and Methods for Using Same STS, MMP3, AADAC LPL 885/4885LIPG 862/4885AGXT 210/4885

“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.