SCHEMBL7672652

SCHEMBL7672652

COC(=O)C1C(COCc2ccccc2)OC(=O)N1C(C)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 1/20 0.39
LMNA P02545 2/20 0.38
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
ALDH1A1 P00352 2/20 0.37
CYP3A4 P08684 2/20 0.37
TSHR P16473 2/20 0.37
CYP1A2 P05177 1/20 0.37
POLB P06746 1/20 0.37
CYP2D6 P10635 1/20 0.37
PSMB11 A5LHX3 1/20 0.37
PSMD11 O00231 1/20 0.37
PSMD12 O00232 1/20 0.37
PSMD14 O00487 1/20 0.37
PSMA7 O14818 1/20 0.37
PSMD3 O43242 1/20 0.37
PSMC3 P17980 1/20 0.37
PSMB1 P20618 1/20 0.37
PSMA1 P25786 1/20 0.37
PSMA2 P25787 1/20 0.37

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
SCHEMBL7668275 0.90 CYP2C9 (0.38) LMNACYP2C9CYP2C19ALDH1A1CYP3A4
SCHEMBL7685510 0.85 CASP1 (0.39) LMNACASP1
SCHEMBL7674117 0.85 KCNA5 (0.40) KCNA5ALDH1A1TSHRPOLBNR3C2
SCHEMBL7673238 0.82 KCNA5 (0.39) KCNA5LMNAALDH1A1CYP3A4TSHR
SCHEMBL7674321 0.81 CHRM4 (0.44) ALDH1A1SMN1; SMN2
SCHEMBL7672014 0.79 CYP2D6 (0.39) KCNA5CYP3A4TSHRCYP1A2POLB
SCHEMBL7667651 0.79 CYP2D6 (0.39) KCNA5CYP3A4TSHRCYP1A2POLB
SCHEMBL7672498 0.78 MAPT (0.39) KCNA5LMNACYP2C19ALDH1A1CYP3A4
SCHEMBL7665863 0.78 CYP2D6 (0.40) KCNA5LMNACYP2C19ALDH1A1CYP3A4
SCHEMBL7674192 0.78 MAPT (0.39) KCNA5LMNACYP2C19ALDH1A1CYP3A4

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