SCHEMBL9006986

SCHEMBL9006986

CC(=O)OOc1cccc(CC2CCC(O)C2c2nc(-c3ccccc3)c(-c3ccccc3)o2)c1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 13/20 0.53
PTGER4 P35408 5/20 0.42
PTGER3 P43115 2/20 0.42
TBXA2R P21731 1/20 0.41
PTGER2 P43116 1/20 0.41
PTGDR Q13258 1/20 0.41
NR4A2 P43354 3/20 0.39
RXRA P19793 2/20 0.39
RXRB P28702 2/20 0.39
RXRG P48443 1/20 0.39
PTGER1 P34995 1/20 0.39
PPARG P37231 2/20 0.37
PPARA Q07869 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 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
SCHEMBL9006826 0.92 PTGIR (0.54) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL8056058 0.87 PTGIR (0.63) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL9007180 0.86 PTGIR (0.72) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL8546568 0.82 PTGIR (0.51) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL27334702 0.82 PTGIR (0.47) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL9006831 0.82 PTGIR (0.55) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL9006873 0.81 PTGIR (0.52) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL9007078 0.79 PTGIR (0.62) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL8547349 0.78 PTGIR (0.47) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL7487193 0.78 PTGIR (0.72) PTGIRPTGER4PTGER3TBXA2RPTGER2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0736018-A1 4,5-DIARYLOXAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-10-09 EP disclosed