SCHEMBL8412775

SCHEMBL8412775

COC(=O)COc1cccc2c1CCC(CCn1cnc(-c3ccccc3)c1-c1ccccc1)C2

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 19/20 0.49
PTGDR Q13258 9/20 0.49
FAAH O00519 1/20 0.45

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
SCHEMBL8809968 0.91 PTGIR (0.59) PTGIRPTGDR
SCHEMBL8412776 0.87 PTGIR (0.45) PTGIRPTGDR
SCHEMBL8810596 0.87 PTGIR (0.46) PTGIRPTGDR
SCHEMBL8412019 0.82 PTGIR (0.65) PTGIRPTGDR
SCHEMBL8411232 0.81 PTGIR (0.49) PTGIRFAAH
SCHEMBL8412021 0.78 PTGIR (0.51) PTGIRPTGDR
SCHEMBL8410514 0.77 PTGIR (0.54) PTGIRPTGDR
SCHEMBL8576525 0.75 PTGIR (0.62) PTGIRPTGDR
SCHEMBL7772464 0.74 PTGIR (0.53) PTGIRPTGDR
SCHEMBL8412769 0.72 PTGIR (0.59) PTGIRPTGDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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