SCHEMBL30696599

SCHEMBL30696599

CCOC(=O)Cc1cccc(OCCN2CCN(C(=O)OC(C)(C)C)CC2)c1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 5/20 0.53
AURKA O14965 1/20 0.49
RPS6KB1 P23443 1/20 0.49
GPR4 P46093 1/20 0.49
HRH2 P25021 4/20 0.48
HRH1 P35367 4/20 0.48
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
DRD2 P14416 1/20 0.45
DRD3 P35462 1/20 0.45
LTA4H P09960 1/20 0.45
GPR119 Q8TDV5 1/20 0.45
CYP4F2 P78329 1/20 0.45
CYP4A11 Q02928 1/20 0.45
SIGMAR1 Q99720 1/20 0.44

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
SCHEMBL30696664 0.95 HRH2 (0.55) EPHX2HRH2HRH1
SCHEMBL30696788 0.94 EPHX2 (0.55) EPHX2HRH2HRH1SIGMAR1
SCHEMBL30696783 0.88 EPHX2 (0.56) EPHX2GPR4KDM4EALDH1A1SMN1; SMN2
SCHEMBL29910776 0.84 EPHX2 (0.56) EPHX2GPR4KDM4EALDH1A1SMN1; SMN2
SCHEMBL23303209 0.84 EPHX2 (0.56) EPHX2GPR4KDM4EALDH1A1SMN1; SMN2
SCHEMBL30696817 0.83 EPHX2 (0.56) EPHX2HRH2HRH1KDM4EALDH1A1
SCHEMBL30812113 0.82 EPHX2 (0.60) EPHX2GPR4KDM4EALDH1A1SMN1; SMN2
SCHEMBL30696767 0.82 EPHX2 (0.58) EPHX2HRH2HRH1KDM4ESIGMAR1
SCHEMBL7402027 0.81 ALDH1A1 (0.62) KDM4EALDH1A1SMN1; SMN2
SCHEMBL31245991 0.81 EPHX2 (0.59) EPHX2GPR4KDM4EALDH1A1SMN1; SMN2

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
EP-4543439-A2 NRF2 PROTEIN DEGRADERS Ganymede Oncology, Inc. (US) 2025-04-30 EP disclosed
WO-2024006742-A2 NRF2 PROTEIN DEGRADERS DRACEN PHARMACEUTICALS, INC. (US) 2024-01-04 WO disclosed