SCHEMBL3683263

SCHEMBL3683263

CC(C)C(CCCCCN1C(=O)CC[C@@H]1/C=C/[C@@](C)(O)C(F)(F)c1ccccc1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 20/20 0.52
PTGER3 P43115 10/20 0.51
PTGER2 P43116 7/20 0.46
PTGER1 P34995 1/20 0.42

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
SCHEMBL3674143 0.86 PTGER4 (0.70) PTGER4PTGER3PTGER2PTGER1
SCHEMBL3674145 0.86 PTGER4 (0.70) PTGER4PTGER3PTGER2PTGER1
SCHEMBL3674182 0.84 PTGER4 (0.58) PTGER4PTGER3PTGER2PTGER1
SCHEMBL3674186 0.84 PTGER4 (0.58) PTGER4PTGER3PTGER2PTGER1
SCHEMBL3675239 0.83 PTGER4 (0.61) PTGER4PTGER3PTGER2PTGER1
SCHEMBL2209048 0.80 PTGER4 (0.62) PTGER4PTGER3PTGER2PTGER1
SCHEMBL2210072 0.80 PTGER4 (0.62) PTGER4PTGER3PTGER2PTGER1
SCHEMBL2210082 0.80 PTGER4 (0.62) PTGER4PTGER3PTGER2PTGER1
SCHEMBL2209058 0.80 PTGER4 (0.62) PTGER4PTGER3PTGER2PTGER1
SCHEMBL2211071 0.79 PTGER4 (0.45) PTGER4PTGER3PTGER2

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-1513589-B1 1,5-DISUBSTITUTED PYRROLID-2-ONE DERIVATIVES FOR USE AS EP4 RECEPTOR AGONISTS IN THE TREATMENT OF EYE DISEASES SUCH AS GLAUCOMA MERCK FROSST CANADA LTD (CA) 2010-11-10 EP claimed