SCHEMBL8965706

SCHEMBL8965706

COC(=O)COc1cccc(CCCC(=O)O/N=C(\N)C(c2ccccc2)c2ccccc2)c1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.52
MEN1 O00255 2/20 0.52
PTGIR P43119 1/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
RECQL P46063 1/20 0.47
TDP1 Q9NUW8 4/20 0.46
LMNA P02545 1/20 0.45
PTGDR2 Q9Y5Y4 4/20 0.44
POLB P06746 1/20 0.44
PPARG P37231 2/20 0.43
PPARA Q07869 2/20 0.43
GAA P10253 1/20 0.41

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
SCHEMBL8358861 1.00 KMT2A (0.52) KMT2AMEN1PTGIRL3MBTL1RECQL
SCHEMBL8354920 0.85 KMT2A (0.51) KMT2AMEN1PTGIRL3MBTL1RECQL
SCHEMBL8354868 0.81 MEN1 (0.52) KMT2AMEN1PTGIRL3MBTL1PTGDR2
SCHEMBL8356611 0.78 PPARA (0.60) KMT2AMEN1PTGIRLMNAPPARG
SCHEMBL8356514 0.78 PPARA (0.51) KMT2AMEN1PPARGPPARAGAA
SCHEMBL8356517 0.78 PPARA (0.51) KMT2AMEN1PPARGPPARAGAA
SCHEMBL8358858 0.77 PTGIR (0.55) KMT2AMEN1PTGIRPTGDR2PPARG
SCHEMBL8358859 0.77 PTGIR (0.55) KMT2AMEN1PTGIRPTGDR2PPARG
SCHEMBL8350669 0.75 PTGIR (0.81) KMT2AMEN1PTGIRL3MBTL1PTGDR2
SCHEMBL8350671 0.75 PTGIR (0.81) KMT2AMEN1PTGIRL3MBTL1PTGDR2

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-5536736-A CARDIOVASCULAR DISORDERS ONO PHARMACEUTICAL CO., LTD. (JP) 1996-07-16 US disclosed
US-5378716-A Prostaglandin agonists ONO PHARMACEUTICAL CO., LTD. (JP) 1995-01-03 US disclosed