SCHEMBL9538148

SCHEMBL9538148

CCOC(=O)OC1CCCCN1C(=O)Cc1c(C)cc(C)cc1F

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.42
MEN1 O00255 4/20 0.42
SMN1; SMN2 Q16637 2/20 0.39
GAA P10253 1/20 0.38
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37
POLB P06746 1/20 0.35
GPR174 Q9BXC1 1/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
TSHR P16473 1/20 0.35
OPRM1 P35372 1/20 0.35
OPRK1 P41145 1/20 0.35

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
SCHEMBL9536573 0.92 MEN1 (0.43) KMT2AMEN1SMN1; SMN2MAPK1POLB
SCHEMBL9538662 0.88 SMN1; SMN2 (0.41) KMT2AMEN1SMN1; SMN2GAAALOX15
SCHEMBL9537518 0.87 ALDH1A1 (0.36) KMT2AMEN1SMN1; SMN2GAAPOLB
SCHEMBL9741393 0.84 FKBP1A (0.48) KMT2AMEN1SMN1; SMN2GAAMAPK1
SCHEMBL9538119 0.84 TSHR (0.36) KMT2AMEN1SMN1; SMN2MAPK1ALDH1A1
SCHEMBL9535560 0.83 TSHR (0.38) KMT2AMEN1SMN1; SMN2MAPK1ALDH1A1
SCHEMBL9535087 0.83 FKBP1A (0.39) KMT2AMEN1SMN1; SMN2OPRM1OPRK1
SCHEMBL9535123 0.81 TSHR (0.37) KMT2AMEN1SMN1; SMN2MAPK1KDM4E
SCHEMBL9536076 0.81 SMN1; SMN2 (0.38) KMT2AMEN1SMN1; SMN2GAAPOLB
SCHEMBL9536216 0.81 ALDH1A1 (0.38) KMT2AMEN1SMN1; SMN2MAPK1POLB

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
EP-0355599-B1 3-ARYL-PYRROLIDINE-2,4-DIONES BAYER AG (DE) 1993-05-19 EP disclosed
EP-0355599-A1 3-Aryl-pyrrolidine-2,4-diones BAYER AG (DE) 1990-02-28 EP disclosed