SCHEMBL5463131

SCHEMBL5463131

COC(=O)c1ccc(CN(C(C(=O)OC(C)(C)C)C(C)C)S(=O)(=O)c2ccc(OC)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 6/20 0.54
TAS2R14 Q9NYV8 7/20 0.52
MMP2 P08253 5/20 0.52
MMP9 P14780 5/20 0.52
MMP8 P22894 5/20 0.52
MMP13 P45452 5/20 0.52
PTGES O14684 1/20 0.47
TAS2R8 Q9NYW2 1/20 0.47
CXCR3 P49682 1/20 0.47
MEP1B Q16820 1/20 0.46

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
SCHEMBL11956143 1.00 BMP1 (0.54) BMP1TAS2R14MMP2MMP9MMP8
SCHEMBL5451163 0.91 TAS2R14 (0.64) BMP1TAS2R14MMP2MMP9MMP8
SCHEMBL7089279 0.88 MMP2 (0.59) BMP1TAS2R14MMP2MMP9MMP8
SCHEMBL7089280 0.88 MMP2 (0.59) BMP1TAS2R14MMP2MMP9MMP8
SCHEMBL6388613 0.85 MMP2 (0.71) BMP1MMP2MMP9MMP8MMP13
SCHEMBL6388611 0.85 MMP2 (0.71) BMP1MMP2MMP9MMP8MMP13
SCHEMBL6389641 0.85 TAS2R14 (0.58) BMP1TAS2R14MMP2MMP9MMP8
SCHEMBL6389646 0.85 TAS2R14 (0.58) BMP1TAS2R14MMP2MMP9MMP8
SCHEMBL6388691 0.83 MMP2 (0.51) BMP1TAS2R14MMP2MMP9MMP8
SCHEMBL5457250 0.83 ADAMTS4 (0.58) MMP2MMP9MMP8MMP13CXCR3

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
US-8231858-B2 Diagnostic imaging agents with MMP inhibitory activity GE HEALTHCARE LIMITED (GB) 2012-07-31 US disclosed
US-20070071670-A1 Diagnostic imaging agents with mmp inhibitory activity GE HEALTHCARE LIMITED (GB) 2007-03-29 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-20070071670-A1 Diagnostic imaging agents with mmp inhibitory activity MMP1, MMP3, MMP7 BMP1 863/4885TAS2R14 4815/4885MMP2 15/4885

“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.