SCHEMBL6257223

SCHEMBL6257223

CCCCC(=O)OOc1ccccc1F

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.50
MEN1 O00255 1/20 0.50
RECQL P46063 1/20 0.50
KMT2A Q03164 1/20 0.50
FAAH O00519 9/20 0.45
HTR7 P34969 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
POLB P06746 1/20 0.40
ATM Q13315 1/20 0.40
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
CXCL8 P10145 1/20 0.39

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
SCHEMBL29009924 0.84 KDM4E (0.65) KDM4EMEN1RECQLKMT2AFAAH
SCHEMBL27602026 0.83 KDM4E (0.44) KDM4EMEN1KMT2AFAAHL3MBTL1
SCHEMBL18322640 0.79 MEN1 (0.58) KDM4EMEN1RECQLKMT2AL3MBTL1
SCHEMBL11345155 0.79 L3MBTL1 (0.57) KDM4EMEN1RECQLKMT2AL3MBTL1
SCHEMBL18261164 0.78 KMT2A (0.57) KDM4EMEN1RECQLKMT2ACES2
SCHEMBL16149020 0.78 MEN1 (0.47) KDM4EMEN1RECQLKMT2ACES2
SCHEMBL18261165 0.77 KMT2A (0.56) KDM4EMEN1RECQLKMT2ACES2
SCHEMBL8355648 0.77 P2RX7 (0.47) KDM4EMEN1RECQLKMT2ACES2
SCHEMBL8351886 0.77 PPARG (0.48) KDM4EMEN1RECQLKMT2A
SCHEMBL28317770 0.77 KDM4E (0.51) KDM4EMEN1RECQLKMT2AL3MBTL1

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-1579276-A1 NOVEL POLYHYDROXYALKANOATE HAVING AMIDE, SULFONIC ACID OR SULFONATE ESTER GROUP, CHARGE CONTROL AGENT AND TONER CANON KABUSHIKI KAISHA (JP) 2005-09-28 EP disclosed
WO-2004061529-A1 NOVEL POLYHYDROXYALKANOATE HAVING AMIDE, SULFONIC ACID OR SULFONATE ESTER GROUP, CHARGE CONTROL AGENT AND TONER CANON KABUSHIKI KAISHA (JP) 2004-07-22 WO disclosed