SCHEMBL9537518

SCHEMBL9537518

COC(=O)OC1CCCN1C(=O)Cc1c(C)cc(C)cc1F

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
OPRM1 P35372 1/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 2/20 0.35
LMNA P02545 1/20 0.35
PKM P14618 1/20 0.35
EPHX2 P34913 1/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
GAA P10253 1/20 0.35
DPP4 P27487 2/20 0.34
HRH3 Q9Y5N1 2/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
HTT P42858 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CNR1 P21554 1/20 0.34
POLB P06746 1/20 0.33

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
SCHEMBL9535862 0.92 ALDH1A1 (0.39) ALDH1A1OPRM1HPGDEPHX2KMT2A
SCHEMBL9535584 0.87 SMN1; SMN2 (0.38) SMN1; SMN2KDM4ELMNAPKMKMT2A
SCHEMBL9538148 0.87 KMT2A (0.42) ALDH1A1OPRM1SMN1; SMN2KDM4EKMT2A
SCHEMBL9727465 0.83 DPP4 (0.46) ALDH1A1OPRM1HPGDSMN1; SMN2LMNA
SCHEMBL9536573 0.78 MEN1 (0.43) OPRM1HPGDSMN1; SMN2EPHX2KMT2A
SCHEMBL9535279 0.78 PLA2G1B (0.36) ALDH1A1GAAPOLB
SCHEMBL9537713 0.77 KMT2A (0.55) ALDH1A1SMN1; SMN2KDM4ELMNAKMT2A
SCHEMBL9536801 0.77 POLB (0.39) OPRM1POLB
SCHEMBL9535638 0.75 TACR1 (0.39) SMN1; SMN2KMT2AMEN1
SCHEMBL9741393 0.75 FKBP1A (0.48) ALDH1A1HPGDSMN1; SMN2KDM4EKMT2A

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