SCHEMBL8065447

SCHEMBL8065447

O=C(O)COc1cccc(CC2=C(c3nc(-c4ccccc4)c(-c4ccccc4)o3)CCC2)c1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 13/20 0.82
FABP4 P15090 4/20 0.61
KDM4E B2RXH2 1/20 0.58
MEN1 O00255 1/20 0.58
ALDH1A1 P00352 1/20 0.58
CYP1A2 P05177 1/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2D6 P10635 1/20 0.58
HPGD P15428 1/20 0.58
KMT2A Q03164 1/20 0.58
HSD17B10 Q99714 1/20 0.58
PTGER4 P35408 4/20 0.51
PTGER3 P43115 2/20 0.51
TBXA2R P21731 1/20 0.44
PTGER2 P43116 1/20 0.44
PTGDR Q13258 1/20 0.44
PTGER1 P34995 1/20 0.41
FABP3 P05413 1/20 0.41
PLA2G10 O15496 1/20 0.41
PLA2G2A P14555 1/20 0.41

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
SCHEMBL9006762 0.87 PTGIR (0.71) PTGIRFABP4KDM4EMEN1ALDH1A1
SCHEMBL8066060 0.85 PTGIR (0.68) PTGIRFABP4KDM4EMEN1ALDH1A1
SCHEMBL9006753 0.85 PTGIR (0.69) PTGIRFABP4KDM4EMEN1ALDH1A1
SCHEMBL7964792 0.84 PTGIR (0.66) PTGIRFABP4KDM4EMEN1ALDH1A1
SCHEMBL8056893 0.83 PTGIR (0.58) PTGIRFABP4KDM4EMEN1ALDH1A1
SCHEMBL8056766 0.82 PTGIR (0.64) PTGIRFABP4KDM4EMEN1ALDH1A1
SCHEMBL7490978 0.82 FABP4 (0.62) PTGIRFABP4KDM4EMEN1ALDH1A1
SCHEMBL7957353 0.82 PTGIR (0.64) PTGIRFABP4KDM4EMEN1ALDH1A1
SCHEMBL8069442 0.81 PTGIR (0.60) PTGIRFABP4KDM4EMEN1ALDH1A1
SCHEMBL8055514 0.81 PTGIR (0.84) PTGIRFABP4KDM4EMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0736018-B1 4,5-DIARYLOXAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2000-07-05 EP disclosed
US-6025375-A INHIBITORY ACTIVITY ON PLATELET AGGREGATION, VASODILATING ACTIVITY, ANTIHYPERTENSIVE ACTIVITY OR THE LIKE AND ARE PROSTAGLANDIN I.SUB.2 AGONISTS, FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-02-15 US disclosed
WO-1995017393-A1 4,5-DIARYLOXAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-06-29 WO disclosed