SCHEMBL11225960

SCHEMBL11225960

C#CN(C(=O)NC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
ALDH1A1 P00352 4/20 0.43
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HDAC1 Q13547 2/20 0.41
HDAC8 Q9BY41 2/20 0.41
HDAC3 O15379 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
IDO1 P14902 1/20 0.41
ALOX15 P16050 1/20 0.41
CA9 Q16790 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HSD17B10 Q99714 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
NCOR2 Q9Y618 1/20 0.41

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
SCHEMBL4560019 0.77 L3MBTL1 (0.46) L3MBTL1TDP1ALDH1A1RAB9AKMT2A
SCHEMBL27521078 0.77 L3MBTL1 (0.55) L3MBTL1TDP1ALDH1A1NPC1RAB9A
SCHEMBL2394240 0.76 NPSR1 (0.43) L3MBTL1TDP1ALDH1A1NPC1RAB9A
SCHEMBL1621882 0.74 CCR6 (0.47) L3MBTL1ALDH1A1NPC1RAB9AMEN1
SCHEMBL483415 0.74 NPSR1 (0.44) L3MBTL1TDP1ALDH1A1NPC1RAB9A
SCHEMBL2913044 0.74 TDP1 (0.47) L3MBTL1TDP1ALDH1A1NPC1RAB9A
SCHEMBL10626822 0.74 TDP1 (0.47) L3MBTL1TDP1ALDH1A1NPC1RAB9A
SCHEMBL1620812 0.72 KDM4E (0.40) L3MBTL1TDP1ALDH1A1NPC1RAB9A
SCHEMBL1622085 0.71 SMN1; SMN2 (0.49) TDP1ALDH1A1NPC1RAB9AMEN1
SCHEMBL76489 0.71 ALDH1A1 (0.67) TDP1ALDH1A1NPC1RAB9AMEN1

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
US-4321276-A INSECTICIDE CIBA-GEIGY CORPORATION (US) 1982-03-23 US disclosed
US-4321276-A INSECTICIDE CIBA-GEIGY CORPORATION (US) 1982-03-23 US disclosed