SCHEMBL7628945

SCHEMBL7628945

CCN(CC)NC(=O)C(F)C(C)=O

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL27842117 0.73 KDM4E (0.38) KDM4EL3MBTL1
SCHEMBL27878811 0.71 ALDH1A2 (0.38) KDM4EL3MBTL1
SCHEMBL29005993 0.71 KDM4E (0.37) KDM4EL3MBTL1
SCHEMBL6227802 0.69
Hydrochloric Acid SCHEMBL11770269 0.67 KDM4E (0.41) KDM4EL3MBTL1
SCHEMBL6601203 0.67 LMNA (0.36)
SCHEMBL1695072 0.65
SCHEMBL2774457 0.64
SCHEMBL28302601 0.64 MGAM (0.39) KDM4E
SCHEMBL7622688 0.64 KDM4E (0.38) KDM4EL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0996606-B1 CATALYSED FLUORINATION OF CARBONYL COMPOUNDS F2 CHEMICALS LTD (GB) 2002-01-16 EP disclosed
US-6300511-B1 FLUORINATING CARBONYL COMPOUND BY REPLACEMENT OF ALPHA-HYDROGEN ATOM WITH FLUORINE COMPRISING REACTING COMPOUND WITH FLUORINATING AGENT IN PRESENCE OF CATALYTICALLY EFFECTIVE AMOUNT OF TRANSITION METAL-CONTAINING CATALYST F2 CHEMICALS LIMITED (GB) 2001-10-09 US disclosed
EP-0996606-A1 CATALYSED FLUORINATION OF CARBONYL COMPOUNDS F2 Chemicals Ltd. (GB) 2000-05-03 EP disclosed
WO-1999003802-A1 CATALYSED FLUORINATION OF CARBONYL COMPOUNDS F2 CHEMICALS LIMITED (GB) 1999-01-28 WO disclosed