SCHEMBL8079368

SCHEMBL8079368

CCC1(C(CC=C[C@H]2C(O[Si](C)(C)C(C)(C)C)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O)O[Si](C)(C)C(C)(C)C)CCC1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGER2 P43116 2/20 0.54
PTGIR P43119 2/20 0.54
PDE4D Q08499 1/20 0.46
PTGER1 P34995 3/20 0.45
PTGER3 P43115 3/20 0.45
PTGER4 P35408 2/20 0.45
LMNA P02545 3/20 0.43
ALDH1A1 P00352 2/20 0.43
TBXA2R P21731 2/20 0.43
PTGFR P43088 2/20 0.43
PTGDR Q13258 1/20 0.43
SLCO2A1 Q92959 1/20 0.43
HPGD P15428 2/20 0.41
ABCC4 O15439 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
HIF1A Q16665 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 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
SCHEMBL7583983 1.00 PTGER2 (0.54) PTGER2PTGIRPDE4DPTGER1PTGER3
SCHEMBL7590855 0.94 PTGER2 (0.49) PTGER2PTGIRPDE4DPTGER1PTGER3
SCHEMBL7588668 0.94 PTGER2 (0.49) PTGER2PTGIRPDE4DPTGER1PTGER3
SCHEMBL2047465 0.92 PDE4D (0.48) PTGER2PTGIRPDE4DPTGER1PTGER3
SCHEMBL2047469 0.92 PDE4D (0.48) PTGER2PTGIRPDE4DPTGER1PTGER3
SCHEMBL2047473 0.92 PDE4D (0.48) PTGER2PTGIRPDE4DPTGER1PTGER3
SCHEMBL2047466 0.92 PDE4D (0.48) PTGER2PTGIRPDE4DPTGER1PTGER3
SCHEMBL7600274 0.91 PTGER2 (0.59) PTGER2PTGIRPDE4DPTGER1PTGER3
SCHEMBL8087920 0.91 PTGER2 (0.59) PTGER2PTGIRPDE4DPTGER1PTGER3
SCHEMBL8092628 0.90 PTGER2 (0.48) PTGER2PTGIRPDE4DPTGER1PTGER3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6110969-A Cycloalkyl-prostaglandin E2 derivatives ONO PHARMACEUTICAL CO. LTD. (JP) 2000-08-29 US disclosed