SCHEMBL13705266

SCHEMBL13705266

COC[C@]1(O)CCCC[C@H]1n1cnc(C(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2CCOc2ccc(C#N)cn2)c1-c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.35
GABRA5 P31644 1/20 0.34
HPGDS O60760 2/20 0.32
HSD11B1 P28845 2/20 0.32
USP30 Q70CQ3 2/20 0.31
PRMT5 O14744 2/20 0.31
HCRTR1 O43613 2/20 0.31
HCRTR2 O43614 2/20 0.31
PIK3CD O00329 1/20 0.31
EGFR P00533 1/20 0.31
SRC P12931 1/20 0.31

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
SCHEMBL4286681 0.94 HSD11B1 (0.35) HSD11B1HCRTR1HCRTR2
SCHEMBL13705267 0.90 HCRTR1 (0.35) GPR119GABRA5HPGDSHCRTR1HCRTR2
SCHEMBL13705262 0.90 HPGDS (0.33) GPR119GABRA5HPGDSHSD11B1USP30
SCHEMBL13705256 0.88 EGFR (0.35) GPR119HPGDSHSD11B1USP30EGFR
SCHEMBL13705261 0.87 HPGDS (0.34) HPGDSUSP30PRMT5HCRTR1HCRTR2
SCHEMBL13705254 0.87 HPGDS (0.36) GPR119HPGDSHSD11B1USP30PRMT5
Hydrochloric Acid SCHEMBL4752479 0.86 USP19 (0.35) HSD11B1HCRTR1HCRTR2
Hydrochloric Acid SCHEMBL4289682 0.86 USP19 (0.35) HSD11B1HCRTR1HCRTR2
SCHEMBL13705306 0.86 HPGDS (0.35) HPGDSHSD11B1USP30PRMT5HCRTR1
SCHEMBL13705263 0.85 IDH1 (0.36) HPGDSUSP30PRMT5HCRTR1HCRTR2

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-20090227560-A1 Substituted imidazole compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-09-10 US disclosed
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 GPR119 310/4885GABRA5 1948/4885HPGDS 1198/4885
US-20090227560-A1 Substituted imidazole compound and use thereof REN, ACE, AGT GPR119 310/4885GABRA5 1948/4885HPGDS 1198/4885

“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.