SCHEMBL7078540

SCHEMBL7078540

COC(=O)C(C1CCC(N(Cc2ccccc2)C(C)=O)CC1)N(C)S(=O)(=O)c1ccc(-c2ccc(OC)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 12/20 0.68
MMP1 P03956 11/20 0.68
MMP2 P08253 9/20 0.68
MMP3 P08254 9/20 0.68
MMP7 P09237 7/20 0.68
MMP9 P14780 5/20 0.51
MMP8 P22894 4/20 0.51
CXCR3 P49682 3/20 0.44
UBE2M P61081 1/20 0.44
DCUN1D1 Q96GG9 1/20 0.44
KCNA5 P22460 1/20 0.44
PTGES O14684 1/20 0.43
TAS2R14 Q9NYV8 1/20 0.43
TAS2R8 Q9NYW2 1/20 0.43
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
BMP1 P13497 1/20 0.42

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
SCHEMBL7078223 0.85 MMP13 (0.65) MMP13MMP1MMP2MMP3MMP7
SCHEMBL7241427 0.81 MMP13 (1.00) MMP13MMP1MMP2MMP3MMP7
SCHEMBL6372187 0.80 MMP13 (0.60) MMP13MMP1MMP2MMP3MMP7
SCHEMBL7084780 0.78 MMP1 (0.66) MMP13MMP1MMP2MMP3MMP7
SCHEMBL7078461 0.77 MMP13 (0.58) MMP13MMP1MMP2MMP3MMP7
SCHEMBL6294217 0.77 MMP13 (0.55) MMP13MMP1MMP2MMP3MMP7
SCHEMBL7243832 0.76 MMP13 (0.89) MMP13MMP1MMP2MMP3MMP7
SCHEMBL7347667 0.75 MMP13 (0.51) MMP13MMP1MMP2MMP3MMP7
SCHEMBL7347774 0.74 MMP13 (0.54) MMP13MMP1MMP2MMP3MMP7
SCHEMBL7347770 0.74 MMP13 (0.54) MMP13MMP1MMP2MMP3MMP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030144292-A1 Carbocyclic side chain containing, N-substituted metalloprotease inhibitors PROCTER & GAMBLE COMPANY, THE 2003-07-31 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-20030144292-A1 Carbocyclic side chain containing, N-substituted metalloprotease inhibitors MMP2, MMP3, CMA1 MMP13 20/4885MMP1 6/4885MMP2 1/4885

“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.