SCHEMBL3506136

SCHEMBL3506136

CC(C)(C)OC(=O)N1CCN(Cc2ccccc2)CC1Cc1ccc(O)cc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 2/20 0.54
NR1H3 Q13133 2/20 0.54
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA4 P22748 2/20 0.50
CA9 Q16790 2/20 0.50
PARP1 P09874 1/20 0.50
DPP4 P27487 2/20 0.47
HDAC1 Q13547 1/20 0.47
DPP7 Q9UHL4 1/20 0.46
ROCK1 Q13464 1/20 0.44
ABHD6 Q9BV23 1/20 0.43
DAGLA Q9Y4D2 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
BCHE P06276 1/20 0.42
ACHE P22303 1/20 0.42
BACE1 P56817 1/20 0.42
ABCB1 P08183 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
SCHEMBL3495123 1.00 NR1H2 (0.54) NR1H2NR1H3CA1CA2CA4
SCHEMBL8448438 0.94 NR1H2 (0.58) NR1H2NR1H3CA1CA2CA4
SCHEMBL6099695 0.94 NR1H2 (0.58) NR1H2NR1H3CA1CA2CA4
SCHEMBL8229118 0.92 NR1H2 (0.54) NR1H2NR1H3CA1CA2CA4
SCHEMBL5369120 0.92 NR1H2 (0.54) NR1H2NR1H3CA1CA2CA4
SCHEMBL6099031 0.92 NR1H2 (0.54) NR1H2NR1H3CA1CA2CA4
SCHEMBL13705076 0.91 NR1H2 (0.53) NR1H2NR1H3CA1CA2CA4
SCHEMBL5378968 0.89 LMNA (0.53) NR1H2NR1H3CA1CA2CA4
SCHEMBL3506688 0.88 NR1H2 (0.51) NR1H2NR1H3CA1CA2CA4
SCHEMBL3506686 0.88 NR1H2 (0.51) NR1H2NR1H3CA1CA2CA4

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-20100210635-A1 RENIN INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-19 US disclosed
EP-1999117-A2 RENIN INHIBITORS Takeda Pharmaceutical Company Limited (JP) 2008-12-10 EP disclosed
WO-2007117961-A2 RENIN INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-10-18 WO 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-20100210635-A1 RENIN INHIBITORS REN, ACE, AGT NR1H2 1643/4885NR1H3 1391/4885CA1 1185/4885

“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.