SCHEMBL13705307

SCHEMBL13705307

COC[C@]1(O)CCCC[C@H]1n1cnc(C(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2CCOC(=O)Nc2ccccc2)c1-c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 3/20 0.34
P2RY12 Q9H244 1/20 0.33
HPGDS O60760 2/20 0.33
CHRM3 P20309 3/20 0.33
ACKR3 P25106 1/20 0.32
FPR3 P25089 1/20 0.32
FPR2 P25090 1/20 0.32
APLNR P35414 1/20 0.32
PARP1 P09874 1/20 0.32
KDM1A O60341 1/20 0.31
BCHE P06276 2/20 0.31
FGFR3 P22607 1/20 0.31
KDR P35968 1/20 0.31
HCRTR1 O43613 1/20 0.31
HCRTR2 O43614 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
SCHEMBL4283618 0.93 CHRM3 (0.34) CHRM3BCHEHCRTR1HCRTR2
SCHEMBL13705254 0.92 HPGDS (0.36) USP30HPGDSACKR3APLNRPARP1
SCHEMBL13705306 0.91 HPGDS (0.35) USP30HPGDSACKR3APLNRPARP1
SCHEMBL13705256 0.89 EGFR (0.35) USP30HPGDSACKR3APLNRPARP1
SCHEMBL13705261 0.89 HPGDS (0.34) USP30HPGDSACKR3APLNRPARP1
SCHEMBL13705262 0.88 HPGDS (0.33) USP30HPGDSACKR3APLNRHCRTR1
SCHEMBL13705145 0.86 ABHD6 (0.42) USP30HPGDSPARP1
SCHEMBL13705257 0.86 USP30 (0.34) USP30HPGDSACKR3APLNRPARP1
SCHEMBL13705312 0.85 PRMT5 (0.36) USP30HPGDSPARP1KDM1A
SCHEMBL13705315 0.85 USP30 (0.36) USP30HPGDSACKR3APLNR

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 USP30 3128/4885P2RY12 2069/4885HPGDS 1198/4885
US-20090227560-A1 Substituted imidazole compound and use thereof REN, ACE, AGT USP30 3128/4885P2RY12 2069/4885HPGDS 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.