SCHEMBL13705255

SCHEMBL13705255

COC[C@]1(O)CCCC[C@H]1n1cnc(C(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2C[C@H](O)c2ccccc2)c1-c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 4/20 0.33
HPGDS O60760 2/20 0.33
ABHD6 Q9BV23 1/20 0.32
DAGLA Q9Y4D2 1/20 0.32
EGFR P00533 1/20 0.32
SRC P12931 1/20 0.32
ROCK2 O75116 1/20 0.32
PARP1 P09874 1/20 0.32
SCD5 Q86SK9 1/20 0.32
USP19 O94966 1/20 0.32
GPR119 Q8TDV5 2/20 0.31
ACKR3 P25106 1/20 0.31
ATM Q13315 1/20 0.31
APLNR P35414 1/20 0.31
IDO1 P14902 3/20 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
SCHEMBL13705260 1.00 USP30 (0.33) USP30HPGDSABHD6DAGLAEGFR
SCHEMBL4294366 0.93 USP19 (0.32) USP19
SCHEMBL4295186 0.93 USP19 (0.32) USP19
SCHEMBL13705256 0.89 EGFR (0.35) USP30HPGDSABHD6DAGLAEGFR
SCHEMBL13705145 0.89 ABHD6 (0.42) USP30HPGDSABHD6DAGLAEGFR
SCHEMBL13705259 0.89 IDH1 (0.34) USP30HPGDSABHD6DAGLAAPLNR
SCHEMBL13705258 0.89 IDH1 (0.34) USP30HPGDSABHD6DAGLAAPLNR
SCHEMBL13705257 0.89 USP30 (0.34) USP30HPGDSABHD6DAGLAEGFR
SCHEMBL13705297 0.87 APLNR (0.34) USP30HPGDSABHD6DAGLAEGFR
SCHEMBL13705291 0.87 USP30 (0.34) USP30HPGDSABHD6DAGLAEGFR

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-20090156612-A1 Substituted imidazole compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 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 USP30 3128/4885HPGDS 1198/4885ABHD6 3736/4885
US-20090227560-A1 Substituted imidazole compound and use thereof REN, ACE, AGT USP30 3128/4885HPGDS 1198/4885ABHD6 3736/4885

“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.