SCHEMBL30899459

SCHEMBL30899459

CC(C)(C)OC(=O)[C@@]1(C(=O)O)NCc2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.38
MAPK1 P28482 1/20 0.35
KDM1A O60341 1/20 0.35
LMNA P02545 1/20 0.34
BLM P54132 1/20 0.34
NR1H2 P55055 3/20 0.33
RXRA P19793 2/20 0.33
NR1H3 Q13133 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
GPR119 Q8TDV5 1/20 0.33
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
RECQL P46063 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL715619 1.00 EPHX2 (0.38) EPHX2MAPK1KDM1ALMNABLM
SCHEMBL304611 1.00 EPHX2 (0.38) EPHX2MAPK1KDM1ALMNABLM
SCHEMBL5211064 0.86 MAPK1 (0.36) EPHX2MAPK1KDM1ALMNABLM
SCHEMBL1325109 0.82 THRB (0.38) LMNABLM
SCHEMBL23183322 0.80 EPHX2 (0.39) EPHX2MAPK1KDM1ALMNABLM
SCHEMBL17648648 0.80 EPHX2 (0.39) EPHX2MAPK1KDM1ALMNABLM
SCHEMBL19122693 0.77 EPHX2 (0.37) EPHX2MAPK1KDM1ADDB1CRBN
SCHEMBL27945905 0.75 EPHX2 (0.38) EPHX2MAPK1MEN1KMT2AGPR119
SCHEMBL28146558 0.71 ALDH1A1 (0.37) KDM1ABLMRECQLALDH1A1CYP3A4
SCHEMBL1202127 0.71 ESR2 (0.41) LMNABLMNR1H2NR1H3RECQL

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
CN-118108706-A Glutarimide C4医药公司 2024-05-31 CN disclosed
CN-111278815-B Glutarimide C4医药公司 2024-03-08 CN disclosed