SCHEMBL9154155

SCHEMBL9154155

CCN(CCCCCC(=O)c1ccc(F)cc1)Cc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.70
BCHE P06276 5/20 0.62
ACHE P22303 5/20 0.62
HTR7 P34969 1/20 0.51
HDAC3 O15379 2/20 0.50
HDAC1 Q13547 2/20 0.50
HDAC2 Q92769 2/20 0.50
HDAC8 Q9BY41 2/20 0.50
NCOR2 Q9Y618 2/20 0.50
APP P05067 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
MAOB P27338 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
Fumaric Acid SCHEMBL9152970 0.94 L3MBTL1 (0.64) L3MBTL1BCHEACHEHTR7HDAC3
Fumaric Acid SCHEMBL9153281 0.94 L3MBTL1 (0.64) L3MBTL1BCHEACHEHTR7HDAC3
SCHEMBL6847922 0.90 L3MBTL1 (0.65) L3MBTL1BCHEACHEHTR7NPC1
SCHEMBL5321633 0.85 L3MBTL1 (0.62) L3MBTL1BCHEACHEHDAC3HDAC1
SCHEMBL9149764 0.82 BCHE (0.55) L3MBTL1BCHEACHEHDAC3HDAC1
SCHEMBL14376142 0.81 BCHE (0.74) BCHEACHEHDAC3HDAC1HDAC2
SCHEMBL14376859 0.81 BCHE (0.74) BCHEACHEHDAC3HDAC1HDAC2
SCHEMBL14376731 0.81 BCHE (0.74) BCHEACHEHDAC3HDAC1HDAC2
SCHEMBL7346155 0.81 L3MBTL1 (0.56) L3MBTL1HTR7HDAC3HDAC1HDAC2
SCHEMBL6701558 0.81 L3MBTL1 (0.71) L3MBTL1HTR7NPC1RAB9A

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
EP-0401715-B1 Aminoketone compounds TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1995-01-25 EP claimed