SCHEMBL8056151

SCHEMBL8056151

O=C(O)COc1cccc(C2CCCC2Cc2nc(-c3ccccc3)c(-c3ccccc3)o2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 10/20 0.59
FABP4 P15090 1/20 0.52
KDM4E B2RXH2 2/20 0.50
CYP3A4 P08684 2/20 0.50
HPGD P15428 2/20 0.50
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2D6 P10635 1/20 0.50
KMT2A Q03164 1/20 0.50
HSD17B10 Q99714 1/20 0.50
PTGER4 P35408 2/20 0.47
PTGER3 P43115 2/20 0.47
TBXA2R P21731 2/20 0.47
PTGER2 P43116 1/20 0.47
PTGDR Q13258 1/20 0.47
PPARD Q03181 4/20 0.45
NR4A2 P43354 3/20 0.44
RXRA P19793 2/20 0.44
RXRB P28702 2/20 0.44

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
SCHEMBL8066936 0.98 PTGIR (0.59) PTGIRFABP4KDM4ECYP3A4HPGD
SCHEMBL9006890 0.87 PTGIR (0.51) PTGIRKDM4ECYP3A4HPGDALDH1A1
SCHEMBL9006887 0.86 PTGIR (0.49) PTGIRKDM4ECYP3A4HPGDPTGER4
SCHEMBL9006922 0.85 PTGIR (0.51) PTGIRKDM4ECYP3A4HPGDALDH1A1
SCHEMBL8055942 0.85 PTGIR (0.66) PTGIRFABP4KDM4ECYP3A4HPGD
SCHEMBL9006917 0.84 PTGIR (0.49) PTGIRKDM4ECYP3A4HPGDPTGER4
SCHEMBL27337328 0.83 PTGIR (0.46) PTGIRKDM4ECYP3A4HPGDTBXA2R
SCHEMBL8056487 0.82 PTGIR (0.85) PTGIRFABP4KDM4ECYP3A4HPGD
SCHEMBL8055541 0.81 FABP4 (0.58) PTGIRFABP4KDM4ECYP3A4HPGD
SCHEMBL27408640 0.81 PTGIR (0.46) PTGIRKDM4ECYP3A4HPGDTBXA2R

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