SCHEMBL21667263

SCHEMBL21667263

O=C1CC(=O)N(CCOCc2ccccc2)C(=O)N1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.50
KMT2A Q03164 8/20 0.50
MAPT P10636 7/20 0.49
ALDH1A1 P00352 5/20 0.49
PKM P14618 3/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
LTA4H P09960 1/20 0.43
HSD17B10 Q99714 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
POLB P06746 2/20 0.43
RECQL P46063 2/20 0.43
PSMD14 O00487 1/20 0.43
MMP2 P08253 1/20 0.43
DNMT1 P26358 1/20 0.43
APEX1 P27695 1/20 0.43
PTPN7 P35236 1/20 0.43
HBB P68871 1/20 0.43
KDM4C Q9H3R0 1/20 0.43

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
SCHEMBL9864517 0.81 GSK3A (0.61) MEN1KMT2AMAPTALDH1A1PKM
SCHEMBL209877 0.80 ALDH1A1 (0.72) MEN1KMT2AMAPTALDH1A1PKM
Potassium SCHEMBL11515942 0.79 ALDH1A1 (0.70) MEN1KMT2AMAPTALDH1A1PKM
SCHEMBL77739 0.77 KMT2A (0.73) MEN1KMT2AMAPTALDH1A1PKM
SCHEMBL18344445 0.75 MAPT (0.57) MEN1KMT2AMAPTALDH1A1PKM
SCHEMBL5586057 0.75 MAPT (0.57) MEN1KMT2AMAPTALDH1A1PKM
SCHEMBL1401654 0.74 GSK3A (0.56) MEN1KMT2AMAPTALDH1A1PKM
SCHEMBL25035706 0.73 PKM (0.56) MEN1KMT2AMAPTALDH1A1PKM
SCHEMBL14139251 0.73 KMT2A (0.51) MEN1KMT2AMAPTALDH1A1PKM
SCHEMBL5014355 0.73 MEN1 (0.51) MEN1KMT2AMAPTALDH1A1PKM

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-3702352-A1 PYRIMIDINEDIONE COMPOUND AGAINST CARDIAC CONDITIONS Myokardia, Inc. (US) 2020-09-02 EP disclosed
EP-3010910-B1 PYRIMIDINEDIONE COMPOUNDS AGAINST CARDIAC CONDITIONS MYOKARDIA INC (US) 2020-02-05 EP disclosed