SCHEMBL31372014

SCHEMBL31372014

CC(C)(C)OC(=O)CCOCCNC(=O)CC1C2CC3CC(C2)CC1C3

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 6/20 0.40
TLR2 O60603 2/20 0.38
TLR1 Q15399 2/20 0.38
HSD11B1 P28845 3/20 0.36
ANO1 Q5XXA6 1/20 0.34
FDFT1 P37268 1/20 0.33
P2RX7 Q99572 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
PLK1 P53350 1/20 0.31
MLYCD O95822 1/20 0.31
CACNA1H O95180 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
SCHEMBL5697635 0.75 HSD11B1 (0.52) EPHX2HSD11B1ANO1P2RX7
SCHEMBL16866495 0.74 MEN1 (0.40) EPHX2TLR2TLR1PLK1MLYCD
SCHEMBL28978104 0.74 MEN1 (0.40) EPHX2TLR2TLR1PLK1MLYCD
SCHEMBL19164207 0.73 TLR2 (0.36) EPHX2TLR2TLR1MLYCD
SCHEMBL25029719 0.73 TLR2 (0.37) EPHX2TLR2TLR1PLK1MLYCD
SCHEMBL16863816 0.73 TLR2 (0.37) EPHX2TLR2TLR1PLK1MLYCD
SCHEMBL30271864 0.73 CASP2 (0.41) EPHX2TLR2TLR1PLK1
SCHEMBL15676126 0.73 TLR2 (0.38) EPHX2TLR2TLR1L3MBTL1PLK1
SCHEMBL15705980 0.73 HSD11B1 (0.46) EPHX2HSD11B1ANO1P2RX7L3MBTL1
SCHEMBL14742521 0.72 TDP1 (0.49) TLR2TLR1

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-2025034789-A1 ARYLBENZOISOXAZOLE COMPOUNDS AS IP6K AND IPMK DEGRADERS AND METHODS OF USE THEREOF THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2025-02-13 WO disclosed