SCHEMBL569306

SCHEMBL569306

CC(C)OP(=O)(OC(C)C)C(=O)NC[C@@H](CNS(=O)(=O)c1ccc(Oc2ccccc2)cc1)N(C)OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 11/20 0.50
CA2 P00918 6/20 0.50
CA9 Q16790 6/20 0.50
CA12 O43570 5/20 0.45
CA1 P00915 5/20 0.45
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
PDK1 Q15118 1/20 0.41
PDK2 Q15119 1/20 0.41
PDK3 Q15120 1/20 0.41
PDK4 Q16654 1/20 0.41
ADAMTS4 O75173 5/20 0.40
MMP13 P45452 6/20 0.39
MMP14 P50281 4/20 0.39
MMP1 P03956 4/20 0.39
ADAMTS5 Q9UNA0 3/20 0.39
MEP1B Q16820 1/20 0.39
MMP9 P14780 4/20 0.39
ADAM33 Q9BZ11 2/20 0.38
CACNA1B Q00975 1/20 0.38

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
SCHEMBL3709324 0.89 MMP2 (0.63) MMP2CA2CA9CA12CA1
SCHEMBL569308 0.81 MMP2 (0.50) MMP2CA2CA9CA12CA1
SCHEMBL569487 0.81 MMP2 (0.50) MMP2CA2CA9CA12CA1
SCHEMBL16601950 0.79 MMP2 (0.57) MMP2CA2CA9CA12CA1
SCHEMBL569412 0.79 MMP2 (0.56) MMP2CA2CA9CA12CA1
SCHEMBL10029051 0.78 MMP2 (0.71) MMP2CA2CA9CA12CA1
SCHEMBL568567 0.77 MMP2 (0.72) MMP2CA2CA9CA12CA1
SCHEMBL569752 0.77 MMP2 (0.72) MMP2CA2CA9CA12CA1
SCHEMBL3712936 0.75 MMP2 (0.51) MMP2CA2CA9CA12CA1
SCHEMBL16602231 0.71 MMP2 (0.49) MMP2CA2CA9CA12CA1

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-20120035140-A1 CARBAMOYLPHOSPHONATES AS INHIBITORS AND USES THEREOF YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM, LTD. (IL) 2012-02-09 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-20120035140-A1 CARBAMOYLPHOSPHONATES AS INHIBITORS AND USES THEREOF MMP9, MMP26, MMP25 MMP2 10/4885CA2 91/4885CA9 104/4885

“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.