SCHEMBL8079366

SCHEMBL8079366

CCCCC1(C(O)CC=C[C@H]2[C@H](O)CC(=O)[C@@H]2C/C=C\CCCC(=O)O)CCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 7/20 0.71
PTGER2 P43116 5/20 0.71
PTGER4 P35408 2/20 0.63
NR1I2 O75469 1/20 0.63
ESR1 P03372 1/20 0.63
PGR P06401 1/20 0.63
HPGD P15428 1/20 0.63
TSHR P16473 1/20 0.63
TBXA2R P21731 1/20 0.63
MAPK1 P28482 1/20 0.63
PTGER1 P34995 1/20 0.63
OPRK1 P41145 1/20 0.63
PTGFR P43088 1/20 0.63
PTGER3 P43115 1/20 0.63
PDE4D Q08499 1/20 0.63

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
SCHEMBL7169600 1.00 PTGIR (0.71) PTGIRPTGER2PTGER4NR1I2ESR1
SCHEMBL7177032 0.97 PTGIR (0.70) PTGIRPTGER2PTGER4NR1I2ESR1
SCHEMBL7171732 0.96 PTGIR (0.77) PTGIRPTGER2PTGER4NR1I2ESR1
SCHEMBL23352912 0.96 PTGIR (0.77) PTGIRPTGER2PTGER4NR1I2ESR1
SCHEMBL16374815 0.96 PTGIR (0.77) PTGIRPTGER2PTGER4NR1I2ESR1
SCHEMBL23352995 0.96 PTGIR (0.77) PTGIRPTGER2PTGER4NR1I2ESR1
SCHEMBL23352556 0.96 PTGIR (0.77) PTGIRPTGER2PTGER4NR1I2ESR1
SCHEMBL7176984 0.96 PTGIR (0.77) PTGIRPTGER2PTGER4NR1I2ESR1
SCHEMBL29799019 0.96 PTGIR (0.77) PTGIRPTGER2PTGER4NR1I2ESR1
SCHEMBL7169146 0.94 PTGIR (0.75) PTGIRPTGER2PTGER4NR1I2ESR1

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 claimed