SCHEMBL485035

SCHEMBL485035

CC(C)(C)OC(=O)N1CCC2(CCC(N3CCN(C(C)(C)C)CC3)CC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.44
HPGD P15428 1/20 0.41
USP2 O75604 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
RECQL P46063 1/20 0.39
EPHX1 P07099 1/20 0.39
HRH3 Q9Y5N1 3/20 0.39
EPHX2 P34913 1/20 0.38
CYP11B2 P19099 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
PTPN2 P17706 1/20 0.36
PTPN1 P18031 1/20 0.36
PTPN6 P29350 1/20 0.36

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
SCHEMBL940349 0.88 HRH3 (0.48) GPR119HPGDUSP2SMN1; SMN2RECQL
SCHEMBL346826 0.86 HPGD (0.47) GPR119HPGDUSP2SMN1; SMN2RECQL
SCHEMBL21341638 0.84 USP2 (0.50) GPR119HPGDUSP2SMN1; SMN2RECQL
SCHEMBL484901 0.83 SIGMAR1 (0.38) HRH3
SCHEMBL27162932 0.81 GPR119 (0.43) GPR119HPGDUSP2SMN1; SMN2RECQL
SCHEMBL2870337 0.81 L3MBTL3 (0.44) GPR119HPGDUSP2SMN1; SMN2RECQL
SCHEMBL13131030 0.80 SIGMAR1 (0.35) HRH3
SCHEMBL25365082 0.80 USP2 (0.55) GPR119HPGDUSP2SMN1; SMN2RECQL
SCHEMBL4827409 0.79 HPGD (0.46) GPR119HPGDUSP2SMN1; SMN2RECQL
SCHEMBL25547105 0.79 GPR119 (0.50) GPR119HPGDUSP2SMN1; SMN2RECQL

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130231327-A1 Substituted Spiro-Amide Compounds GRUENENTHAL GMBH (DE) 2013-09-05 US disclosed
US-8455475-B2 Substituted spiro-amide compounds GRUENENTHAL GMBH (DE) 2013-06-04 US disclosed
EP-2411381-A1 SUBSTITUTED SPIRO-AMIDE COMPOUNDS Grünenthal GmbH (DE) 2012-02-01 EP disclosed
US-20100249095-A1 Substituted Spiro-amide Compounds GRUENENTHAL GMBH (DE) 2010-09-30 US disclosed
WO-2010108651-A1 SUBSTITUTED SPIRO-AMIDE COMPOUNDS Grünenthal GmbH (DE) 2010-09-30 WO 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-20130231327-A1 Substituted Spiro-Amide Compounds BDKRB1, BDKRB2, REN GPR119 206/4885HPGD 386/4885USP2 4864/4885
US-20100249095-A1 Substituted Spiro-amide Compounds BDKRB1, BDKRB2, REN GPR119 206/4885HPGD 386/4885USP2 4864/4885

“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.