SCHEMBL2004234

SCHEMBL2004234

NC(=O)CCCCOS(=O)(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.50
MMP9 P14780 2/20 0.50
HDAC1 Q13547 10/20 0.49
HDAC2 Q92769 10/20 0.49
HDAC3 O15379 9/20 0.49
HDAC4 P56524 9/20 0.49
HDAC7 Q8WUI4 9/20 0.49
HDAC10 Q969S8 9/20 0.49
HDAC11 Q96DB2 9/20 0.49
HDAC8 Q9BY41 9/20 0.49
HDAC6 Q9UBN7 9/20 0.49
HDAC9 Q9UKV0 9/20 0.49
HDAC5 Q9UQL6 9/20 0.49
LTB4R Q15722 1/20 0.48
MMP7 P09237 1/20 0.45
MMP14 P50281 1/20 0.45
FABP1 P07148 1/20 0.44
PARL Q9H300 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43

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
SCHEMBL2005594 0.95 MMP2 (0.51) MMP2MMP9HDAC1HDAC2HDAC3
SCHEMBL2009142 0.91 MMP2 (0.52) MMP2MMP9HDAC1HDAC2HDAC3
SCHEMBL2009256 0.88 CA1 (0.51) MMP2MMP9CA12CA1CA2
SCHEMBL2013112 0.88 MMP9 (0.49) MMP2MMP9HDAC1HDAC2HDAC3
SCHEMBL2013462 0.88 LMNA (0.42) MMP2MMP9HDAC1HDAC2HDAC3
SCHEMBL2009394 0.87 MMP9 (0.51) MMP2MMP9HDAC1HDAC2HDAC3
SCHEMBL2009235 0.87 ALDH1A1 (0.47) LTB4RCA12CA1CA9
SCHEMBL2008430 0.87 MEP1B (0.40) MMP2MMP9HDAC1HDAC2HDAC3
SCHEMBL2012396 0.84 MEN1 (0.50) CA12CA1CA2CA9
SCHEMBL2011553 0.84 MMP2 (0.44) MMP2MMP9HDAC1HDAC2HDAC3

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 MMP2 1086/4885MMP9 1159/4885HDAC1 565/4885

“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.