SCHEMBL13705244

SCHEMBL13705244

CN(C)CCCOC[C@@]1(O)CCCC[C@@H]1n1cnc(C(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2Cc2ccccc2)c1-c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ABHD6 Q9BV23 1/20 0.39
DAGLA Q9Y4D2 1/20 0.39
PARP1 P09874 1/20 0.36
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
USP30 Q70CQ3 5/20 0.35
TACR1 P25103 1/20 0.34
DPP4 P27487 1/20 0.34
HPGDS O60760 2/20 0.33
NR1H2 P55055 2/20 0.33
NR1H3 Q13133 2/20 0.33
PRMT5 O14744 1/20 0.33
GPR119 Q8TDV5 3/20 0.33
HDAC1 Q13547 1/20 0.32
EGFR P00533 1/20 0.32
SRC P12931 1/20 0.32

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
SCHEMBL4289126 0.93 TACR1 (0.34) ABHD6DAGLATACR1
SCHEMBL13705227 0.92 ABHD6 (0.40) ABHD6DAGLAPARP1JAK2JAK1
SCHEMBL13705247 0.91 ABHD6 (0.40) ABHD6DAGLAPARP1JAK2JAK1
SCHEMBL13705240 0.91 ABHD6 (0.39) ABHD6DAGLAPARP1DPP4HPGDS
SCHEMBL13705239 0.90 ABHD6 (0.39) ABHD6DAGLAPARP1USP30DPP4
SCHEMBL13705145 0.90 ABHD6 (0.42) ABHD6DAGLAPARP1JAK2JAK1
SCHEMBL13705219 0.89 ABHD6 (0.41) ABHD6DAGLAPARP1JAK2JAK1
SCHEMBL13705169 0.89 ABHD6 (0.43) ABHD6DAGLAPARP1JAK2JAK1
SCHEMBL4286201 0.89 ABHD6 (0.43) ABHD6DAGLAPARP1JAK2JAK1
SCHEMBL13705233 0.89 ABHD6 (0.43) ABHD6DAGLAPARP1JAK2JAK1

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-20090227560-A1 Substituted imidazole compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-09-10 US disclosed
US-20090156612-A1 Substituted imidazole compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 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 (2 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-20090156612-A1 Substituted imidazole compound and use thereof REN, ACE, AGT ABHD6 3736/4885DAGLA 4309/4885PARP1 3523/4885
US-20090227560-A1 Substituted imidazole compound and use thereof REN, ACE, AGT ABHD6 3736/4885DAGLA 4309/4885PARP1 3523/4885

“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.