SCHEMBL680561

SCHEMBL680561

Cc1ccc(Oc2ccc(C(=O)NS(C)(=O)=O)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 4/20 0.65
SMN1; SMN2 Q16637 4/20 0.53
HTT P42858 3/20 0.53
HPGD P15428 1/20 0.53
TSHR P16473 1/20 0.53
HDAC1 Q13547 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
MAPK14 Q16539 2/20 0.51
MMP2 P08253 3/20 0.50
CYP3A4 P08684 2/20 0.50
STAT3 P40763 1/20 0.50
GFER P55789 1/20 0.50
MMP9 P14780 2/20 0.49
ALDH1A1 P00352 3/20 0.48
GAA P10253 1/20 0.48
BCL2L1 Q07817 1/20 0.48
MCL1 Q07820 1/20 0.48
SCN9A Q15858 2/20 0.48
NPC1 O15118 3/20 0.47
RAB9A P51151 2/20 0.47

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
SCHEMBL279954 0.89 HDAC1 (0.63) MMP13SMN1; SMN2HTTHPGDHDAC1
SCHEMBL680496 0.89 MMP13 (0.51) MMP13SMN1; SMN2HTTHPGDTSHR
SCHEMBL680791 0.87 CA1 (0.61) MMP13SMN1; SMN2HTTHPGDTSHR
SCHEMBL703171 0.85 BCL2L1 (0.59) MMP13SMN1; SMN2HTTHPGDTSHR
SCHEMBL16319859 0.85 MMP1 (0.56) SMN1; SMN2HTTHPGDTSHRMAPK14
SCHEMBL680466 0.85 EZH2 (0.54) MMP13SMN1; SMN2HTTHPGDTSHR
SCHEMBL679703 0.84 SCN9A (0.49) MMP13SMN1; SMN2HTTHPGDTSHR
SCHEMBL680062 0.84 MMP13 (0.47) MMP13SCN9AMAPT
SCHEMBL678839 0.84 PPARA (0.47) MMP13SCN9ANPSR1
SCHEMBL680096 0.84 SMN1; SMN2 (0.48) MMP13SMN1; SMN2HTTHPGDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2593427-B1 SULFONAMIDE DERIVATIVES AS NAV1.7 INHIBITORS FOR THE TREATMENT OF PAIN PFIZER LTD (GB) 2014-12-24 EP disclosed
US-20120010207-A1 Chemical Compounds PFIZER LIMITED (GB) 2012-01-12 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 (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-20120010207-A1 Chemical Compounds SCN1A, SCN1B, SCN7A MMP13 4543/4885SMN1; SMN2 282/4885HTT 1281/4885

“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.