SCHEMBL8069442

SCHEMBL8069442

O=C(O)COc1cccc(C2=C(Cc3nc(-c4ccccc4)c(-c4ccccc4)o3)CCCC2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 6/20 0.60
FABP4 P15090 3/20 0.57
KDM4E B2RXH2 2/20 0.55
CYP3A4 P08684 2/20 0.55
HPGD P15428 2/20 0.55
MEN1 O00255 1/20 0.55
ALDH1A1 P00352 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2D6 P10635 1/20 0.55
KMT2A Q03164 1/20 0.55
HSD17B10 Q99714 1/20 0.55
RXRA P19793 4/20 0.48
RXRB P28702 4/20 0.48
PPARD Q03181 4/20 0.47
NR4A2 P43354 5/20 0.46
NR4A1 P22736 2/20 0.46
NR4A3 Q92570 2/20 0.46
RXRG P48443 2/20 0.45
ABCC4 O15439 1/20 0.45
C5 P01031 1/20 0.45

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
SCHEMBL8056893 0.98 PTGIR (0.58) PTGIRFABP4KDM4ECYP3A4HPGD
SCHEMBL9006866 0.86 PTGIR (0.51) PTGIRFABP4KDM4ECYP3A4HPGD
SCHEMBL8065101 0.85 RXRA (0.55) PTGIRFABP4KDM4ECYP3A4HPGD
SCHEMBL9006861 0.85 PTGIR (0.50) PTGIRFABP4KDM4ECYP3A4HPGD
SCHEMBL9006860 0.85 PTGIR (0.49) PTGIRFABP4KDM4ECYP3A4HPGD
SCHEMBL9006859 0.83 PTGIR (0.48) PTGIRFABP4KDM4ECYP3A4HPGD
SCHEMBL8075431 0.83 RXRA (0.55) PTGIRFABP4KDM4ECYP3A4HPGD
SCHEMBL8065447 0.81 PTGIR (0.82) PTGIRFABP4KDM4ECYP3A4HPGD
SCHEMBL27320815 0.79 NR4A2 (0.45) PTGIRKDM4ECYP3A4HPGDRXRA
SCHEMBL9452921 0.79 PPARD (0.66) FABP4KDM4ECYP3A4HPGDMEN1

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