SCHEMBL8056752

SCHEMBL8056752

COc1cccc(CC2CCCC(c3nc(-c4ccccc4)c(-c4ccccc4)o3)C2)c1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 10/20 0.51
EED O75530 2/20 0.47
HTR1A P08908 1/20 0.42
SLC6A4 P31645 1/20 0.42
PTGER4 P35408 2/20 0.42
PTGER3 P43115 2/20 0.42
TBXA2R P21731 1/20 0.42
PTGER2 P43116 1/20 0.42
PTGDR Q13258 1/20 0.42
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
RECQL P46063 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL9006873 0.87 PTGIR (0.52) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL8065601 0.86 PTGIR (0.62) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL27344473 0.85 PTGIR (0.47) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL8065136 0.83 KDM4E (0.44) PTGIRRXRARXRBKDM4ELMNA
SCHEMBL8065255 0.80 PTGIR (0.71) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL8074838 0.79 KDM4E (0.46) PTGIRHTR1ARXRARXRBKDM4E
SCHEMBL27579519 0.76 PTGIR (0.50) PTGIRHTR1ASLC6A4PTGER4PTGER3
SCHEMBL27332377 0.75 PTGIR (0.45) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL7490972 0.75 PTGIR (0.49) PTGIRHTR1ASLC6A4RXRARXRB
SCHEMBL7960388 0.74 PTGIR (0.51) PTGIREEDHTR1ASLC6A4PTGER4

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 4 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
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