SCHEMBL3491499

SCHEMBL3491499

Cc1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2CC(=O)O)c(-c2ccccc2)n1-c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KAT7 O95251 2/20 0.40
GPR119 Q8TDV5 2/20 0.39
ABHD6 Q9BV23 1/20 0.38
DAGLA Q9Y4D2 1/20 0.38
USP30 Q70CQ3 6/20 0.38
NR1H2 P55055 2/20 0.38
NR1H3 Q13133 2/20 0.38
MAPT P10636 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ROCK2 O75116 1/20 0.37
PARP1 P09874 1/20 0.37
KAT8 Q9H7Z6 1/20 0.36
TP53 P04637 2/20 0.36
THRB P10828 1/20 0.36

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
SCHEMBL13341218 0.93 PARP1 (0.39) KAT7GPR119ABHD6DAGLAUSP30
SCHEMBL13341002 0.92 KAT7 (0.40) KAT7GPR119ABHD6DAGLAUSP30
SCHEMBL8236038 0.92 KAT7 (0.40) KAT7GPR119ABHD6DAGLAUSP30
SCHEMBL13341219 0.90 HCRTR1 (0.42) KAT7GPR119ABHD6DAGLAUSP30
SCHEMBL8238421 0.90 KAT7 (0.39) KAT7GPR119ABHD6DAGLAUSP30
SCHEMBL8235393 0.89 YAP1 (0.40) KAT7GPR119ABHD6DAGLAUSP30
SCHEMBL3492043 0.89 GPR119 (0.39) KAT7GPR119USP30NR1H2NR1H3
SCHEMBL13341187 0.88 KAT7 (0.39) KAT7GPR119ABHD6DAGLAUSP30
SCHEMBL8235365 0.88 NR1H2 (0.44) KAT7GPR119ABHD6DAGLANR1H2
SCHEMBL8235764 0.88 KAT7 (0.39) KAT7GPR119ABHD6DAGLAUSP30

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-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
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 KAT7 1058/4885GPR119 689/4885ABHD6 2780/4885

“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.