SCHEMBL6684469

SCHEMBL6684469

CC(=O)C(=O)Cc1cccc(C(F)(F)F)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
MAPT P10636 2/20 0.56
ACP3 P15309 1/20 0.53
MAOB P27338 2/20 0.52
EPHX1 P07099 3/20 0.50
HTR2A P28223 1/20 0.50
HTR2C P28335 1/20 0.50
HTR2B P41595 1/20 0.50
HTT P42858 3/20 0.49
HDAC1 Q13547 2/20 0.49
HDAC8 Q9BY41 2/20 0.49
SMYD3 Q9H7B4 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
TAAR1 Q96RJ0 1/20 0.49
HDAC3 O15379 1/20 0.48
HDAC4 P56524 1/20 0.48
HDAC7 Q8WUI4 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC10 Q969S8 1/20 0.48

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
SCHEMBL265041 0.86 MEN1 (0.59) MEN1KMT2AMAPTACP3MAOB
SCHEMBL30412285 0.86 MEN1 (0.59) MEN1KMT2AMAPTACP3MAOB
SCHEMBL2164148 0.85 MEN1 (0.61) MEN1KMT2AMAPTACP3EPHX1
Formaldehyde SCHEMBL9181082 0.83 MEN1 (0.56) MEN1KMT2AMAPTACP3MAOB
SCHEMBL7640356 0.83 MEN1 (0.56) MEN1KMT2AMAPTACP3MAOB
SCHEMBL10441255 0.82 ACP3 (0.59) MEN1KMT2AMAPTACP3MAOB
SCHEMBL6865758 0.82 MEN1 (0.62) MEN1KMT2AMAPTACP3EPHX1
SCHEMBL11273244 0.82 MEN1 (0.49) MEN1KMT2AMAPTACP3MAOB
SCHEMBL11273245 0.82 MEN1 (0.49) MEN1KMT2AMAPTACP3MAOB
SCHEMBL11275212 0.82 MEN1 (0.46) MEN1KMT2AMAPTACP3MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004052280-A2 ANTI-ANGIOGENIC COMPOUNDS AND THEIR USE IN CANCER TREATMENT IMCLONE SYSTEMS INCORPORATED (US) 2004-06-24 WO disclosed