SCHEMBL2011339

SCHEMBL2011339

NC(=O)CCCCOS(=O)(=O)c1ccc(-c2ccc(F)c(F)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.41
PTGS2 P35354 7/20 0.40
PTGS1 P23219 4/20 0.40
MLNR O43193 1/20 0.38
CYP2D6 P10635 1/20 0.38
LTB4R Q15722 1/20 0.36
SOS1 Q07889 1/20 0.35
IDO1 P14902 1/20 0.35
MMP2 P08253 2/20 0.34
MMP9 P14780 2/20 0.34
FFAR4 Q5NUL3 2/20 0.34
CSF1R P07333 1/20 0.34
FABP1 P07148 1/20 0.34

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
SCHEMBL2008430 0.86 MEP1B (0.40) PTGS2PTGS1LTB4RMMP2MMP9
SCHEMBL2013462 0.82 LMNA (0.42) LTB4RMMP2MMP9FABP1
SCHEMBL2004234 0.82 MMP2 (0.50) LTB4RMMP2MMP9FABP1
SCHEMBL2009361 0.82 MEP1B (0.41) PTGS2PTGS1MMP2MMP9
SCHEMBL1711624 0.81 LGMN (0.43) PTGS2PTGS1
SCHEMBL2009235 0.81 ALDH1A1 (0.47) KIF11LTB4R
SCHEMBL2009256 0.80 CA1 (0.51) MMP2MMP9
SCHEMBL2009054 0.79 CA2 (0.46) MMP2MMP9
SCHEMBL2012396 0.78 MEN1 (0.50)
SCHEMBL2005594 0.77 MMP2 (0.51) LTB4RMMP2MMP9

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 KIF11 4843/4885PTGS2 2205/4885PTGS1 1037/4885

“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.