SCHEMBL5963379

SCHEMBL5963379

CC(C)(C)OC(=O)N1C(=O)[C@](C)(O)[C@@H]1C1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.41
HPGD P15428 1/20 0.37
GPR119 Q8TDV5 4/20 0.35
BUB1 O43683 1/20 0.35
BACE1 P56817 2/20 0.34
CTSD P07339 1/20 0.34
PREP P48147 2/20 0.34
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 1/20 0.33
ELANE P08246 1/20 0.33
DDB1 Q16531 2/20 0.33
CRBN Q96SW2 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 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
SCHEMBL5963863 0.75 EPHX1 (0.33) EPHX1HPGDBACE1CTSD
SCHEMBL3733352 0.72 CHRM2 (0.41) EPHX1HPGDGPR119PREPCHRM2
SCHEMBL5964671 0.71 EPHX1 (0.40) EPHX1HPGDGPR119PREPCHRM2
SCHEMBL5964675 0.71 EPHX1 (0.40) EPHX1HPGDGPR119PREPCHRM2
SCHEMBL3733204 0.69 CHRM2 (0.41) EPHX1HPGDGPR119PREPCHRM2
SCHEMBL19217730 0.69 EPHX1 (0.46) EPHX1HPGDGPR119PREPCHRM2
SCHEMBL19217727 0.69 EPHX1 (0.46) EPHX1HPGDGPR119PREPCHRM2
SCHEMBL31046592 0.68 CHRM2 (0.44) EPHX1HPGDGPR119PREPCHRM2
SCHEMBL12620803 0.67 NR1H2 (0.58) EPHX1HPGDGPR119PREPCHRM2
SCHEMBL3744055 0.67 EPHX1 (0.40) EPHX1HPGDGPR119PREPCHRM2

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
EP-0681568-B1 PROCESS FOR PREPARATION OF TAXANE DERIVATIVES AND BETA-LACTAM INTERMEDIATES THEREFOR UNIV NEW YORK STATE RES FOUND (US) 2006-07-26 EP disclosed