SCHEMBL6254239

SCHEMBL6254239

CCCC(F)OC(=O)C1(NC(=O)OC(C)(C)C)CC(CO)C1

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.33
NR1H2 P55055 1/20 0.33
KMT2A Q03164 3/20 0.32
CTSK P43235 3/20 0.32
CTSS P25774 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MEN1 O00255 2/20 0.32
MAPK1 P28482 1/20 0.32
GAA P10253 1/20 0.32
HDAC4 P56524 1/20 0.31
HDAC1 Q13547 1/20 0.31
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL5200876 0.81 KMT2A (0.39) APLNRNR1H2KMT2ACTSKCTSS
SCHEMBL7926354 0.80 KMT2A (0.38) APLNRNR1H2KMT2ACTSKCTSS
SCHEMBL21946033 0.80 KMT2A (0.38) APLNRNR1H2KMT2ACTSKCTSS
SCHEMBL19931893 0.79 KMT2A (0.36) NR1H2KMT2AALDH1A1MEN1MAPK1
SCHEMBL28396159 0.78 KMT2A (0.39) APLNRNR1H2KMT2ACTSKCTSS
SCHEMBL24106816 0.69 KMT2A (0.35) KMT2AALDH1A1MEN1MAPK1TDP1
SCHEMBL22632833 0.69 KMT2A (0.38) APLNRKMT2ACTSKCTSSMEN1
SCHEMBL28251999 0.69 KMT2A (0.40) APLNRNR1H2KMT2ACTSKCTSS
SCHEMBL12173239 0.68 KMT2A (0.38) APLNRKMT2AALDH1A1MEN1MAPK1
SCHEMBL15306516 0.68 KMT2A (0.38) APLNRKMT2AALDH1A1MEN1MAPK1

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-1572601-A1 SOLID-PHASE PREPARATION OF 18 F-LABELLED AMINO ACIDS GE Healthcare Limited (GB) 2005-09-14 EP disclosed
WO-2004056725-A1 SOLID-PHASE PREPARATION OF 18F-LABELLED AMINO ACIDS GE HEALTHCARE LIMITED (GB) 2004-07-08 WO disclosed