SCHEMBL6325815

SCHEMBL6325815

COc1ccc(S(=O)(=O)N2CCCC2CO)cc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.59
PAX8 Q06710 1/20 0.59
MMP1 P03956 3/20 0.56
MMP3 P08254 3/20 0.56
MMP7 P09237 2/20 0.56
MMP9 P14780 1/20 0.56
MMP13 P45452 1/20 0.56
HCRTR1 O43613 4/20 0.56
HCRTR2 O43614 4/20 0.56
LMNA P02545 1/20 0.55
CYP3A4 P08684 1/20 0.54
BRD4 O60885 1/20 0.54
BRD2 P25440 1/20 0.54
ALDH1A1 P00352 2/20 0.53
GAA P10253 1/20 0.53
TSHR P16473 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
HTT P42858 1/20 0.53
MAPK1 P28482 1/20 0.53

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
SCHEMBL8211716 1.00 RAB9A (0.59) RAB9APAX8MMP1MMP3MMP7
SCHEMBL8207295 0.96 MMP1 (0.61) RAB9APAX8MMP1MMP3MMP7
SCHEMBL6977510 0.95 MMP1 (0.63) RAB9APAX8MMP1MMP3MMP7
SCHEMBL7480895 0.90 RAB9A (0.57) RAB9APAX8MMP1MMP3MMP7
SCHEMBL6323512 0.86 RAB9A (0.56) RAB9APAX8MMP1MMP3MMP7
SCHEMBL8211440 0.86 RAB9A (0.56) RAB9APAX8MMP1MMP3MMP7
SCHEMBL12162069 0.86 NPC1 (0.60) RAB9APAX8MMP1MMP3MMP7
SCHEMBL2572076 0.85 MEN1 (0.60) RAB9AMMP1MMP3MMP7MMP13
SCHEMBL5885963 0.85 BRD4 (0.57) RAB9APAX8BRD4BRD2GAA
SCHEMBL6302770 0.85 BRD4 (0.57) RAB9APAX8BRD4BRD2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050014840-A1 Thiol sulfonamide metalloprotease inhibitors PHARMACIA CORPORATION 2005-01-20 US disclosed
US-6747027-B1 SELECTIVELY INHIBITS IN VITRO ACTIVITY OF HUMAN MATRIX METALLOPROTEASE-13 OVER IN VITRO ACTIVITY OF HUMAN MATRIX METALLOPROTEASE-1 PHARMACIA CORPORATION 2004-06-08 US disclosed
CN-1238688-A Thiol sulfonamide metalloprotease inhibitors MONSANTO CO (US) 1999-12-15 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 (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-20050014840-A1 Thiol sulfonamide metalloprotease inhibitors MMP12, MMP13, MMP3 RAB9A 3653/4885PAX8 2579/4885MMP1 13/4885

“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.