SCHEMBL8073014

SCHEMBL8073014

COc1ccc(NC(=O)OCC(=O)c2ccc(S(=O)(=O)N(Cc3ccccc3)Cc3ccccc3)cc2)cc1Cl

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.65
THRB P10828 2/20 0.65
TAS2R14 Q9NYV8 6/20 0.55
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
PTGES O14684 1/20 0.48
TAS2R8 Q9NYW2 1/20 0.48
CXCR3 P49682 1/20 0.48
POLB P06746 1/20 0.48
TSHR P16473 1/20 0.48
TP53 P04637 1/20 0.48
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47

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
SCHEMBL8083933 0.90 MAPT (0.51) MAPTTHRBTAS2R14PTGESCXCR3
SCHEMBL8074729 0.89 TAS2R14 (0.56) MAPTTHRBTAS2R14PTGESTAS2R8
SCHEMBL8074805 0.89 MAPT (0.53) MAPTTHRBTAS2R14CXCR3POLB
SCHEMBL8069684 0.85 TAS2R14 (0.65) MAPTTAS2R14PTGESTAS2R8CXCR3
SCHEMBL8059119 0.84 MAPT (0.59) MAPTTAS2R14PTGESTAS2R8CXCR3
SCHEMBL8070323 0.83 MAPT (0.52) MAPTTAS2R14PTGESTAS2R8CXCR3
SCHEMBL8074725 0.83 MAPT (0.63) MAPTTHRBTAS2R14POLBTP53
SCHEMBL8073250 0.82 TAS2R14 (0.61) MAPTTAS2R14ALDH1A1PTGESTAS2R8
SCHEMBL8059346 0.82 MAPT (0.51) MAPTTAS2R14PTGESCXCR3POLB
SCHEMBL8069963 0.82 TAS2R14 (0.64) MAPTTAS2R14PTGESTAS2R8CXCR3

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
EP-1017685-A1 NEW 2-(3H)-OXAZOLONE DERIVATIVES ALMIRALL-PRODESFARMA, S.A. (ES) 2000-07-12 EP disclosed
WO-1999014205-A1 NEW 2-(3H)-OXAZOLONE DERIVATIVES ALMIRALL PRODESFARMA S.A. (ES) 1999-03-25 WO disclosed