SCHEMBL25957458

SCHEMBL25957458

CC(C)(C)OC(=O)CC1CCN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.48
HPGD P15428 1/20 0.47
KDM4E B2RXH2 1/20 0.46
PKM P14618 1/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46
GLS O94925 3/20 0.45
RECQL P46063 1/20 0.44
EPHX1 P07099 1/20 0.44
IDO1 P14902 1/20 0.43
TDO2 P48775 1/20 0.43
GPR119 Q8TDV5 1/20 0.43
USP2 O75604 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
USP30 Q70CQ3 1/20 0.42
FAAH O00519 1/20 0.42

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
SCHEMBL31189316 1.00 NR1H2 (0.48) NR1H2HPGDKDM4EPKMMEN1
SCHEMBL31588543 1.00 NR1H2 (0.48) NR1H2HPGDKDM4EPKMMEN1
SCHEMBL852498 0.91 KDM4E (0.47) NR1H2HPGDKDM4EPKMMEN1
SCHEMBL20565243 0.91 KDM4E (0.47) NR1H2HPGDKDM4EPKMMEN1
SCHEMBL19511364 0.91 KDM4E (0.47) NR1H2HPGDKDM4EPKMMEN1
SCHEMBL6608848 0.90 HPGD (0.53) NR1H2HPGDKDM4EPKMMAPT
SCHEMBL15874584 0.88 NR1H2 (0.43) NR1H2HPGDKDM4EPKMMEN1
SCHEMBL1899485 0.88 NR1H2 (0.43) NR1H2HPGDKDM4EPKMMEN1
SCHEMBL25314409 0.88 NR1H2 (0.48) NR1H2HPGDKDM4EPKMMEN1
SCHEMBL874037 0.88 KDM4E (0.49) NR1H2HPGDKDM4EPKMMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023146785-A1 PYRROLIDINE COMPOUNDS ELI LILLY AND COMPANY (US) 2023-08-03 WO disclosed