SCHEMBL2006895

SCHEMBL2006895

O=S(=O)(NCCCCO)c1ccc(Br)cc1CCl

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LPAR2 Q9HBW0 2/20 0.39
FABP4 P15090 2/20 0.39
ALDH1A1 P00352 4/20 0.39
RECQL P46063 1/20 0.38
GAA P10253 3/20 0.37
PKM P14618 1/20 0.37
GSTO1 P78417 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
SLC6A9 P48067 1/20 0.36

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
SCHEMBL12571012 0.83 CA1 (0.46) LPAR2FABP4ALDH1A1RECQLGAA
SCHEMBL2008541 0.81 NMT1 (0.44) LPAR2FABP4ALDH1A1RECQLGAA
SCHEMBL2009346 0.77 CNR2 (0.44) LPAR2FABP4ALDH1A1CA1CA2
SCHEMBL2005429 0.74 ALPL (0.50)
SCHEMBL2007611 0.73 GAA (0.59) ALDH1A1GAAPKMCA1CA2
SCHEMBL2013273 0.72 ALDH1A1 (0.59) ALDH1A1GAAPKMCA1CA2
SCHEMBL5499591 0.72 ALDH1A1 (0.59) ALDH1A1GAAPKMCA1CA2
SCHEMBL27784554 0.72 FABP4 (0.52) FABP4ALDH1A1SLC6A9
SCHEMBL12570968 0.71 ATM (0.65) ALDH1A1GAAPKM
SCHEMBL12571016 0.71 RECQL (0.70) FABP4ALDH1A1RECQLPKMCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7964643-B2 Biphenyl-4-sulfonic acid-(4-hydroxybutyl)-amide and derivatives; inhibits osteoclast survival, formation, and/or activity and/or inhibits bone resorption; osteoporosis, rheumatoid arthritis, cancer associated bone disease, Paget's disease, antiinflammatory, -carcinogenic agents; immunostimulants THE UNIVERSITY COURT OF THE UNIVERSITY OF ABERDEEN (GB) 2011-06-21 US disclosed
EP-1756046-B1 ARYL ALKYL SULFONAMIDES AS THERAPEUTIC AGENTS FOR THE TREATMENT OF BONE CONDITIONS UNIV ABERDEEN (GB) 2009-12-09 EP disclosed
US-20080119555-A1 Aryl Alkyl Sulfonamides As Therapeutic Agents For The Treatment Of Bone Conditions THE UNIVERSITY COURT OF THE UNIVERSITY OF ABERDEEN (GB) 2008-05-22 US disclosed
EP-1756046-A2 ARYL ALKYL SULFONAMIDES AS THERAPEUTIC AGENTS FOR THE TREATMENT OF BONE CONDITIONS The University Court of The University of Aberdeen (GB) 2007-02-28 EP disclosed
WO-2005118528-A2 ARYL ALKYL SULFONAMIDES AS THERAPEUTIC AGENTS FOR THE TREATMENT OF BONE CONDITIONS THE UNIVERSITY COURT OF THE UNIVERSITY OF ABERDEEN (GB) 2005-12-15 WO 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-20080119555-A1 Aryl Alkyl Sulfonamides As Therapeutic Agents For The Treatment Of Bone Conditions ARSA, CNKSR1, BCL9L LPAR2 2962/4885FABP4 3203/4885ALDH1A1 1548/4885

“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.