SCHEMBL8074729

SCHEMBL8074729

COc1ccc(NC(=O)OCC(=O)c2ccc(S(=O)(=O)N(Cc3ccccc3)Cc3ccccc3)cc2)cc1F

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 11/20 0.56
MAPT P10636 3/20 0.51
THRB P10828 1/20 0.51
MEP1B Q16820 1/20 0.49
CXCR3 P49682 2/20 0.48
PTGES O14684 1/20 0.48
TAS2R8 Q9NYW2 1/20 0.48
TP53 P04637 1/20 0.47
KMT2A Q03164 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
SCHEMBL8059346 0.90 MAPT (0.51) TAS2R14MAPTCXCR3PTGESTP53
SCHEMBL8073014 0.89 MAPT (0.65) TAS2R14MAPTTHRBCXCR3PTGES
SCHEMBL8070251 0.89 MAPT (0.56) TAS2R14MAPTPTGESTAS2R8TP53
SCHEMBL8069684 0.85 TAS2R14 (0.65) TAS2R14MAPTCXCR3PTGESTAS2R8
SCHEMBL8059119 0.84 MAPT (0.59) TAS2R14MAPTCXCR3PTGESTAS2R8
SCHEMBL8070323 0.83 MAPT (0.52) TAS2R14MAPTCXCR3PTGESTAS2R8
SCHEMBL8074725 0.83 MAPT (0.63) TAS2R14MAPTTHRBTP53KMT2A
SCHEMBL8073250 0.82 TAS2R14 (0.61) TAS2R14MAPTCXCR3PTGESTAS2R8
SCHEMBL8083933 0.82 MAPT (0.51) TAS2R14MAPTTHRBCXCR3PTGES
SCHEMBL8069963 0.82 TAS2R14 (0.64) TAS2R14MAPTCXCR3PTGESTAS2R8

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