SCHEMBL13340244

SCHEMBL13340244

CC(C)(C)OC(=O)N1CCN(C(=O)c2nnn(-c3cccc(OC4CCS(=O)(=O)CC4)c3)c2-c2ccccc2)[C@H](Cc2ccccc2)C1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ABHD6 Q9BV23 1/20 0.45
DAGLA Q9Y4D2 1/20 0.45
NR1H2 P55055 2/20 0.41
NR1H3 Q13133 2/20 0.41
DPP4 P27487 1/20 0.40
USP30 Q70CQ3 2/20 0.39
TP53 P04637 4/20 0.36
MAPT P10636 2/20 0.36
PARP1 P09874 1/20 0.36
PRMT5 O14744 1/20 0.36
BRD4 O60885 1/20 0.35
THRB P10828 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
LMNA P02545 2/20 0.34
CCR3 P51677 1/20 0.34
FAAH O00519 1/20 0.34

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
SCHEMBL3497281 0.91 FAAH (0.35) ABHD6DAGLALMNAFAAH
SCHEMBL8229919 0.88 ABHD6 (0.42) ABHD6DAGLANR1H2NR1H3DPP4
SCHEMBL8238111 0.88 ABHD6 (0.44) ABHD6DAGLANR1H2NR1H3DPP4
SCHEMBL3494753 0.87 ABHD6 (0.49) ABHD6DAGLANR1H2NR1H3DPP4
SCHEMBL3494932 0.87 ABHD6 (0.49) ABHD6DAGLANR1H2NR1H3DPP4
SCHEMBL13340229 0.86 ABHD6 (0.49) ABHD6DAGLANR1H2NR1H3DPP4
SCHEMBL8238321 0.86 ABHD6 (0.49) ABHD6DAGLANR1H2NR1H3DPP4
SCHEMBL3497279 0.85 POLB (0.35) ABHD6DAGLALMNA
SCHEMBL8230130 0.85 ABHD6 (0.41) ABHD6DAGLANR1H2NR1H3DPP4
SCHEMBL13340241 0.84 ABHD6 (0.47) ABHD6DAGLANR1H2NR1H3DPP4

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-20100121048-A1 Cyclic Amine Compound and Use Thereof for the Prophylaxis or Treatment of Hypertension TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-13 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-20100121048-A1 Cyclic Amine Compound and Use Thereof for the Prophylaxis or Treatment of Hypertension REN, AGTR1, AGTR2 ABHD6 2780/4885DAGLA 4388/4885NR1H2 339/4885

“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.