SCHEMBL8066934

SCHEMBL8066934

Oc1cccc(CC2CCCC=C2c2nc(-c3ccccc3)c(-c3ccccc3)o2)c1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 11/20 0.78
PTGER4 P35408 6/20 0.78
PTGER1 P34995 1/20 0.78
PTGER3 P43115 2/20 0.68
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
FABP4 P15090 1/20 0.36
TBXA2R P21731 1/20 0.36
PTGER2 P43116 1/20 0.36
PTGDR Q13258 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CYP19A1 P11511 1/20 0.34

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
SCHEMBL27386880 0.96 PTGIR (0.72) PTGIRPTGER4PTGER1PTGER3ESR1
SCHEMBL27520735 0.94 PTGIR (0.68) PTGIRPTGER4PTGER1PTGER3ESR1
SCHEMBL8066007 0.94 PTGIR (0.68) PTGIRPTGER4PTGER1PTGER3ESR1
SCHEMBL7964164 0.94 PTGIR (0.68) PTGIRPTGER4PTGER1PTGER3ESR1
SCHEMBL8056901 0.91 PTGIR (0.66) PTGIRPTGER4PTGER1PTGER3ESR1
SCHEMBL7990542 0.90 PTGIR (0.76) PTGIRPTGER4PTGER1PTGER3KDM4E
SCHEMBL7489401 0.89 PTGER4 (0.69) PTGIRPTGER4PTGER1PTGER3ESR1
SCHEMBL8129831 0.88 PTGIR (0.78) PTGIRPTGER4PTGER1PTGER3FABP4
SCHEMBL7484991 0.88 PTGIR (0.75) PTGIRPTGER4PTGER1PTGER3FABP4
SCHEMBL7959727 0.87 PTGIR (1.00) PTGIRPTGER4PTGER1PTGER3FABP4

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 6 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
EP-0989975-A1 OXAZOLE COMPOUNDS USEFUL AS PGE2 AGONISTS AND ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-04-05 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-1998055468-A1 OXAZOLE COMPOUNDS USEFUL AS PGE2 AGONISTS AND ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-12-10 WO disclosed
EP-0736018-A1 4,5-DIARYLOXAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-10-09 EP disclosed
WO-1995017393-A1 4,5-DIARYLOXAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-06-29 WO disclosed