SCHEMBL8008629

SCHEMBL8008629

O=C(CCN1C(=O)c2ccccc2C1=O)NOCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.64
ALDH1A1 P00352 2/20 0.52
MAPT P10636 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
TSHR P16473 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.51
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
KDM4E B2RXH2 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.49
GAA P10253 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
SCHEMBL7981993 0.78 HDAC3 (0.64)
SCHEMBL11388585 0.78 ALDH1A1 (0.55) ALDH1A1MAPTL3MBTL1MEN1KMT2A
SCHEMBL4409652 0.77 POLB (0.63) POLBALDH1A1MAPTTDP1TSHR
SCHEMBL9191952 0.77 HDAC3 (0.71) MEN1KMT2AGAA
SCHEMBL8575004 0.77 POLB (0.56) POLBALDH1A1MAPTTDP1L3MBTL1
SCHEMBL8011663 0.77 ACHE (0.51) POLBMAPTTDP1L3MBTL1SMN1; SMN2
SCHEMBL5854957 0.76 HDAC8 (0.56) POLBALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL5854988 0.76 HDAC8 (0.56) POLBALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL23080107 0.76 NPC1 (0.59)
SCHEMBL6763786 0.76 HDAC3 (0.74) MEN1KMT2A

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
US-6056939-A Self-assembling heteropolymetallic chelates as imaging agents and radiopharmaceuticals BRACCO IMAGING S.P.A. (IT) 2000-05-02 US disclosed