SCHEMBL8235393

SCHEMBL8235393

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

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
YAP1 P46937 3/20 0.40
KAT7 O95251 2/20 0.39
USP30 Q70CQ3 3/20 0.38
GPR119 Q8TDV5 2/20 0.37
KAT8 Q9H7Z6 1/20 0.37
ACKR3 P25106 1/20 0.36
ITGB1 P05556 1/20 0.35
ITGA4 P13612 1/20 0.35
ABHD6 Q9BV23 1/20 0.35
DAGLA Q9Y4D2 1/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL13341219 0.90 HCRTR1 (0.42) KAT7USP30GPR119KAT8ABHD6
SCHEMBL3495223 0.89 CNR2 (0.38) TP53MAPT
SCHEMBL3491499 0.89 KAT7 (0.40) KAT7USP30GPR119KAT8ABHD6
SCHEMBL8235764 0.89 KAT7 (0.39) KAT7USP30GPR119KAT8ACKR3
SCHEMBL13341002 0.89 KAT7 (0.40) KAT7USP30GPR119KAT8ACKR3
SCHEMBL13341218 0.88 PARP1 (0.39) KAT7USP30GPR119KAT8ABHD6
SCHEMBL8236038 0.87 KAT7 (0.40) KAT7USP30GPR119KAT8ABHD6
SCHEMBL13341187 0.85 KAT7 (0.39) KAT7USP30GPR119KAT8ACKR3
SCHEMBL8238421 0.85 KAT7 (0.39) KAT7USP30GPR119KAT8ABHD6
SCHEMBL3492043 0.83 GPR119 (0.39) KAT7USP30GPR119KAT8TP53

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
WO-2007094513-A2 CYCLIC AMINE COMPOUND AND USE THEREOF FOR THE PROPHYLAXIS OR TREATMENT OF HYPERTENSION TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-08-23 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-20100121048-A1 Cyclic Amine Compound and Use Thereof for the Prophylaxis or Treatment of Hypertension REN, AGTR1, AGTR2 YAP1 500/4885KAT7 1058/4885USP30 2733/4885

“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.