SCHEMBL7601579

SCHEMBL7601579

C=CCC1(C(O)CC=C[C@H]2C(O)CC(=O)[C@@H]2CC=CCCCC(=O)O)CCC1

nearest known ligand 0.80

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 7/20 0.67
PTGER2 P43116 5/20 0.67
PTGER4 P35408 3/20 0.67
PTGER3 P43115 3/20 0.67
PTGER1 P34995 2/20 0.67
PTGFR P43088 2/20 0.54
NR1I2 O75469 1/20 0.54
ESR1 P03372 1/20 0.54
PGR P06401 1/20 0.54
HPGD P15428 1/20 0.54
TSHR P16473 1/20 0.54
TBXA2R P21731 1/20 0.54
MAPK1 P28482 1/20 0.54
OPRK1 P41145 1/20 0.54
PDE4D Q08499 1/20 0.54

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
SCHEMBL7168123 1.00 PTGIR (0.67) PTGIRPTGER2PTGER4PTGER3PTGER1
SCHEMBL7583578 0.90 PTGIR (0.62) PTGIRPTGER2PTGER4PTGER3PTGER1
SCHEMBL7172670 0.89 PTGIR (0.66) PTGIRPTGER2PTGER4PTGER3PTGER1
SCHEMBL7172708 0.88 PTGIR (0.60) PTGIRPTGER2PTGER4PTGER3PTGER1
SCHEMBL7601722 0.88 PTGIR (0.59) PTGIRPTGER2PTGER4PTGER3PTGER1
SCHEMBL7173448 0.88 PTGIR (0.59) PTGIRPTGER2PTGER4PTGER3PTGER1
SCHEMBL23352912 0.88 PTGIR (0.77) PTGIRPTGER2PTGER4PTGER3PTGER1
SCHEMBL23352995 0.88 PTGIR (0.77) PTGIRPTGER2PTGER4PTGER3PTGER1
SCHEMBL7176984 0.88 PTGIR (0.77) PTGIRPTGER2PTGER4PTGER3PTGER1
SCHEMBL23352556 0.88 PTGIR (0.77) PTGIRPTGER2PTGER4PTGER3PTGER1

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
EP-0860430-B1 Omega-cycloalkyl-prostaglandin E2 derivatives ONO PHARMACEUTICAL CO (JP) 2002-06-12 EP claimed