SCHEMBL8412744

SCHEMBL8412744

CC(=O)Oc1cccc2c1CCC(Cc1cc(C(c3ccccc3)c3ccccc3)no1)=C2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 2/20 0.42
BRD4 O60885 1/20 0.32
CREBBP Q92793 1/20 0.32
KDM4E B2RXH2 2/20 0.32
ESR1 P03372 2/20 0.32
TSHR P16473 2/20 0.32
ABCB11 O95342 1/20 0.32
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.32
ADRA2A P08913 1/20 0.32
CYP2C9 P11712 1/20 0.32
PDE4A P27815 1/20 0.32
ADRA1A P35348 1/20 0.32
OPRK1 P41145 1/20 0.32
STAT6 P42226 1/20 0.32
SLC6A3 Q01959 1/20 0.32
HIF1A Q16665 1/20 0.32
GPR55 Q9Y2T6 1/20 0.32
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31

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
SCHEMBL8412741 0.87 PTGIR (0.58) PTGIRKDM4EALDH1A1HPGDTDP1
SCHEMBL8414334 0.85 PTGIR (0.44) PTGIRBRD4CREBBPKDM4EESR1
SCHEMBL8414349 0.75 PTGIR (0.41) PTGIRKDM4EESR1TSHRABCB11
SCHEMBL8414344 0.75 PTGIR (0.48) PTGIR
SCHEMBL8809706 0.75 MEN1 (0.34) PTGIRKDM4EESR1TSHRABCB11
SCHEMBL8410899 0.73 PTGIR (0.76) PTGIRKDM4EESR1TSHRLMNA
SCHEMBL8414332 0.71 PTGIR (0.59) PTGIRKDM4EALDH1A1HPGDTDP1
SCHEMBL8411433 0.70 PTGIR (0.42) PTGIRKDM4EESR1TSHRLMNA
SCHEMBL8812368 0.70 PTGIR (0.67) PTGIRKDM4ELMNAMEN1KMT2A
SCHEMBL8411189 0.69 PTGIR (0.68) PTGIRTSHRCYP3A4SLC6A3MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0548949-B1 Fused benzeneoxyacetic acid derivatives ONO PHARMACEUTICAL CO (JP) 1997-09-17 EP claimed
EP-0548949-A2 Fused benzeneoxyacetic acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1993-06-30 EP claimed
US-5962439-A CARDIOVASCULAR DISORDER ONO PHARMACEUTICAL CO., LTD. (JP) 1999-10-05 US disclosed
US-5849919-A Fused benzeneoxyacetic acid derivatives which have PGI2 receptor anonist activity ONO PHARMACEUTICAL CO., LTD. (JP) 1998-12-15 US disclosed
EP-0548949-B1 Fused benzeneoxyacetic acid derivatives ONO PHARMACEUTICAL CO (JP) 1997-09-17 EP disclosed
US-5589496-A Fused benzeneoxyacetic acid derivatives which have PGI2 receptor agonist activity ONO PHARMACEUTICAL CO., LTD. (JP) 1996-12-31 US disclosed
EP-0548949-A2 Fused benzeneoxyacetic acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1993-06-30 EP disclosed