SCHEMBL3974963

SCHEMBL3974963

O=C(O)C1CCCC(=O)C1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
BLM P54132 1/20 0.36
PEPD P12955 1/20 0.35
MCL1 Q07820 1/20 0.35
GRM4 Q14833 1/20 0.33
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32

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
SCHEMBL11793423 0.77 MEN1 (0.35) KMT2AMEN1BLMPEPDMCL1
SCHEMBL1306142 0.77 KMT2A (0.35) KMT2AMEN1BLMPEPDGRM4
SCHEMBL9541416 0.77 CA1 (0.40) KMT2AMCL1KDM4EPOLBL3MBTL1
SCHEMBL1234936 0.74 KDM4E (0.36) KMT2AMEN1BLMPEPDKDM4E
SCHEMBL1879279 0.73 CYP2C19 (0.35) KMT2AMEN1BLMMCL1KDM4E
SCHEMBL7337219 0.72 NPC1 (0.36) KMT2AMCL1KDM4EL3MBTL1CA1
SCHEMBL27564747 0.72 MEN1 (0.32) KMT2AMEN1BLMPEPDKDM4E
SCHEMBL932332 0.70
SCHEMBL22468834 0.70
SCHEMBL22612515 0.69 KMT2A (0.50) KMT2AMCL1KDM4EPOLBL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009049018-A1 NOVEL COMPOUNDS AND METHODS OF USING THEM SYNDAX PHARMACEUTICALS, INC. (US) 2009-04-16 WO disclosed
US-4029687-A HERBICIDES CIBA-GEIGY AG (CH) 1977-06-14 US disclosed
US-4004914-A HERBICIDES CIBA-GEIGY AG (CH) 1977-01-25 US disclosed