SCHEMBL7672137

SCHEMBL7672137

COC(=O)CC1OC(=O)N(C(C)c2cccc3ccccc23)C1C(=O)OC

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.39
CYP2C19 P33261 1/20 0.39
GPR139 Q6DWJ6 2/20 0.38
XIAP P98170 2/20 0.38
HSD11B1 P28845 2/20 0.38
CASR P41180 1/20 0.36
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL7670061 0.90 GPR139 (0.39) GPR139XIAPHSD11B1CASR
SCHEMBL7673133 0.86 GPR139 (0.37) GPR139XIAPHSD11B1CASR
SCHEMBL7668438 0.86 GPR139 (0.39) GPR139XIAPHSD11B1CASR
SCHEMBL7669920 0.85 METAP2 (0.41) GPR139XIAPHSD11B1CASRKDM4E
SCHEMBL7663146 0.85 METAP2 (0.41) GPR139XIAPHSD11B1CASRKDM4E
SCHEMBL7668243 0.84 KDM4E (0.42) GPR139HSD11B1KDM4E
SCHEMBL7671032 0.84 HSD11B1 (0.41) GPR139XIAPHSD11B1CASR
SCHEMBL7674018 0.84 HSD11B1 (0.41) GPR139XIAPHSD11B1CASR
SCHEMBL7668338 0.84 HSD11B1 (0.41) GPR139XIAPHSD11B1CASR
SCHEMBL7667160 0.84 HSD11B1 (0.41) GPR139XIAPHSD11B1CASR

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