SCHEMBL7668249

SCHEMBL7668249

CC(C)OC(=O)C1C(C)OC(=O)N1C(C)c1cccc2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.40
ALDH1A1 P00352 1/20 0.35
METAP2 P50579 1/20 0.35
METAP1 P53582 1/20 0.35
CASR P41180 1/20 0.35
CYP2C9 P11712 1/20 0.34
HPGD P15428 1/20 0.34
CYP2C19 P33261 1/20 0.34
HTT P42858 1/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
GPR139 Q6DWJ6 1/20 0.34
XIAP P98170 2/20 0.34
NPBWR1 P48145 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
SCHEMBL7668338 0.90 HSD11B1 (0.41) HSD11B1CASRLMNAGAAGPR139
SCHEMBL7667608 0.89 HSD11B1 (0.40) HSD11B1ALDH1A1METAP2METAP1CASR
SCHEMBL7667577 0.87 HSD11B1 (0.39) HSD11B1ALDH1A1METAP2METAP1CASR
SCHEMBL7672003 0.86 HSD11B1 (0.42) HSD11B1METAP2METAP1CASRXIAP
SCHEMBL7670459 0.84 HSD11B1 (0.37) HSD11B1ALDH1A1METAP2METAP1CASR
SCHEMBL7670457 0.84 HSD11B1 (0.37) HSD11B1ALDH1A1METAP2METAP1CASR
SCHEMBL7667565 0.82 HSD11B1 (0.36) HSD11B1ALDH1A1METAP2METAP1CASR
SCHEMBL7687039 0.82 METAP2 (0.39) HSD11B1METAP2METAP1CASRCYP2C9
SCHEMBL7667659 0.80 KDM4E (0.38) ALDH1A1HPGDLMNAGAA
SCHEMBL7674018 0.79 HSD11B1 (0.41) HSD11B1ALDH1A1CASRLMNAGAA

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
US-6414160-B1 REACTING 5-ALKOXY-2(3H)OXAZOLONE COMPOUND WITH ALDEHYDE COMPOUND IN PRESENCE OF LEWIS ACID CATALYST UBE INDUSTRIES, LTD. (JP) 2002-07-02 US disclosed
EP-1000937-A1 PROCESS FOR PRODUCING 4-ALKOXYCARBONYL-2-OXAZOLIDINONE COMPOUNDS UBE INDUSTRIES LIMITED (JP) 2000-05-17 EP disclosed