SCHEMBL13705262

SCHEMBL13705262

COC[C@]1(O)CCCC[C@H]1n1cnc(C(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2CCOc2ccccn2)c1-c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 2/20 0.33
ABHD6 Q9BV23 1/20 0.33
DAGLA Q9Y4D2 1/20 0.33
EGFR P00533 1/20 0.33
SRC P12931 1/20 0.33
USP30 Q70CQ3 4/20 0.32
GABRA5 P31644 1/20 0.32
GPR119 Q8TDV5 1/20 0.32
HCRTR1 O43613 2/20 0.32
HCRTR2 O43614 2/20 0.32
BACE1 P56817 2/20 0.32
HSD11B1 P28845 1/20 0.32
ACKR3 P25106 1/20 0.32
CTSD P07339 1/20 0.32
APLNR P35414 1/20 0.32
PRMT5 O14744 1/20 0.31
ROCK2 O75116 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
SCHEMBL13705261 0.94 HPGDS (0.34) HPGDSABHD6DAGLAEGFRSRC
SCHEMBL4281791 0.93 HCRTR2 (0.33) HCRTR1HCRTR2
SCHEMBL13705264 0.92 SYK (0.33) HPGDSABHD6DAGLAUSP30GPR119
SCHEMBL13705256 0.92 EGFR (0.35) HPGDSABHD6DAGLAEGFRSRC
SCHEMBL13705254 0.90 HPGDS (0.36) HPGDSUSP30GPR119HCRTR1HCRTR2
SCHEMBL13705267 0.90 HCRTR1 (0.35) HPGDSABHD6DAGLAGABRA5GPR119
SCHEMBL13705263 0.90 IDH1 (0.36) HPGDSABHD6DAGLAEGFRSRC
SCHEMBL13705266 0.90 GPR119 (0.35) HPGDSEGFRSRCUSP30GABRA5
SCHEMBL13705306 0.90 HPGDS (0.35) HPGDSUSP30HCRTR1HCRTR2BACE1
SCHEMBL13705265 0.90 SSTR4 (0.33) ABHD6DAGLA

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 HPGDS 1198/4885ABHD6 3736/4885DAGLA 4309/4885
US-20090227560-A1 Substituted imidazole compound and use thereof REN, ACE, AGT HPGDS 1198/4885ABHD6 3736/4885DAGLA 4309/4885

“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.