SCHEMBL9006873

SCHEMBL9006873

CC(=O)OOc1cccc(CC2CCCC(c3nc(-c4ccccc4)c(-c4ccccc4)o3)C2)c1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 13/20 0.52
PTGER4 P35408 6/20 0.43
PTGER3 P43115 2/20 0.43
TBXA2R P21731 1/20 0.43
PTGER2 P43116 1/20 0.43
PTGDR Q13258 1/20 0.43
NR4A2 P43354 2/20 0.40
RXRA P19793 2/20 0.40
RXRB P28702 2/20 0.40
RXRG P48443 1/20 0.40
PTGER1 P34995 1/20 0.40
FABP4 P15090 1/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
RECQL P46063 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TDP1 Q9NUW8 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
SCHEMBL8056752 0.87 PTGIR (0.51) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL8065601 0.86 PTGIR (0.62) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL9006854 0.85 PTGIR (0.44) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL9007180 0.84 PTGIR (0.72) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL27344473 0.82 PTGIR (0.47) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL9006816 0.81 NR4A2 (0.45) PTGIRNR4A2RXRARXRBRXRG
SCHEMBL9006986 0.81 PTGIR (0.53) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL9006831 0.79 PTGIR (0.55) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL7490338 0.78 PTGIR (0.72) 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