SCHEMBL2963202

SCHEMBL2963202

CS(=O)(=O)c1ccc(S(=O)(=O)N2C(C(=O)NO)CC3CCCC32)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 9/20 0.48
MMP9 P14780 7/20 0.48
MMP12 P39900 1/20 0.48
EPHX2 P34913 1/20 0.45
MMP1 P03956 10/20 0.44
MMP3 P08254 9/20 0.44
MMP7 P09237 9/20 0.44
MMP13 P45452 8/20 0.44
HCRTR1 O43613 1/20 0.42
HCRTR2 O43614 1/20 0.42
MMP8 P22894 1/20 0.42
ADAM17 P78536 1/20 0.41
PSEN1 P49768 1/20 0.41
PSEN2 P49810 1/20 0.41
APH1B Q8WW43 1/20 0.41
NCSTN Q92542 1/20 0.41
APH1A Q96BI3 1/20 0.41
PSENEN Q9NZ42 1/20 0.41
POLB P06746 1/20 0.41
ATM Q13315 1/20 0.39

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
SCHEMBL8324754 1.00 MMP2 (0.48) MMP2MMP9MMP12EPHX2MMP1
SCHEMBL13201315 0.89 MMP2 (0.46) MMP2MMP9MMP12EPHX2MMP1
SCHEMBL8324756 0.88 MMP2 (0.46) MMP2MMP9MMP12MMP1MMP3
SCHEMBL8319091 0.88 MMP9 (0.46) MMP2MMP9MMP12MMP1MMP3
SCHEMBL13201339 0.88 MMP2 (0.46) MMP2MMP9MMP12MMP1MMP3
SCHEMBL8319548 0.87 ACHE (0.53) MMP2MMP9MMP12EPHX2
SCHEMBL13201347 0.87 MMP9 (0.61) MMP2MMP9MMP12MMP1MMP3
SCHEMBL13479959 0.87 ACHE (0.53) MMP2MMP9MMP12EPHX2
SCHEMBL8320621 0.86 POLB (0.60) MMP2MMP9MMP12POLB
SCHEMBL2964063 0.86 PSEN1 (0.43) MMP2MMP9MMP12EPHX2HCRTR1

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-7772270-B2 Imino acid derivatives as inhibitors of matrix metalloproteinases SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2010-08-10 US disclosed
US-20060252752-A1 Octahydrocyclopenta[b]pyrrole-sulfonamide-2-carboxylic acid derivatives; reduced side effects SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2006-11-09 US disclosed
US-20050004166-A1 Imino acid derivatives as inhibitors of matrix metalloproteinases AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-01-06 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 (2 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-20050004166-A1 Imino acid derivatives as inhibitors of matrix metalloproteinases MMP9, MMP1, MMP25 MMP2 5/4885MMP9 1/4885MMP12 22/4885
US-20060252752-A1 Octahydrocyclopenta[b]pyrrole-sulfonamide-2-carboxylic acid derivatives; reduced side effects SULT2A1, ADCYAP1R1, SULT1A1 MMP2 3817/4885MMP9 2450/4885MMP12 3074/4885

“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.