SCHEMBL13340978

SCHEMBL13340978

CCCCC(O)(c1ccccc1)[C@H](C)n1cnc(C(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2Cc2ccccc2)c1-c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABHD6 Q9BV23 1/20 0.42
DAGLA Q9Y4D2 1/20 0.42
DPP4 P27487 1/20 0.38
PARP1 P09874 1/20 0.37
NR1H2 P55055 2/20 0.36
NR1H3 Q13133 2/20 0.36
GPR119 Q8TDV5 1/20 0.35
HDAC1 Q13547 1/20 0.35
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
CA1 P00915 6/20 0.34
CA2 P00918 6/20 0.34
CA4 P22748 6/20 0.34
CA9 Q16790 6/20 0.34
CKS1B P61024 1/20 0.34
SKP1 P63208 1/20 0.34
SKP2 Q13309 1/20 0.34
KLK7 P49862 1/20 0.33
KLK5 Q9Y337 1/20 0.33

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
SCHEMBL3491419 0.91 CA1 (0.36) ABHD6DAGLACA1CA2CA4
SCHEMBL8237607 0.89 ABHD6 (0.37) ABHD6DAGLADPP4PARP1NR1H2
SCHEMBL13340974 0.88 ABHD6 (0.47) ABHD6DAGLADPP4PARP1NR1H2
SCHEMBL13340972 0.87 ABHD6 (0.43) ABHD6DAGLADPP4PARP1NR1H2
SCHEMBL8235524 0.82 ABHD6 (0.46) ABHD6DAGLADPP4PARP1NR1H2
SCHEMBL13340965 0.82 ABHD6 (0.46) ABHD6DAGLADPP4PARP1NR1H2
SCHEMBL13340969 0.82 ABHD6 (0.44) ABHD6DAGLADPP4PARP1NR1H2
SCHEMBL8230011 0.82 ABHD6 (0.46) ABHD6DAGLADPP4PARP1NR1H2
SCHEMBL8230166 0.82 ABHD6 (0.46) ABHD6DAGLADPP4PARP1NR1H2
SCHEMBL8236084 0.81 ABHD6 (0.45) ABHD6DAGLADPP4PARP1NR1H2

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-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
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 4388/4885DPP4 4179/4885

“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.