SCHEMBL6516613

SCHEMBL6516613

CCC(=O)CC(=C(CC(=O)O)C(=O)O)c1cccc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.45
NR4A2 P43354 1/20 0.45
NR4A3 Q92570 1/20 0.45
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
PLK1 P53350 1/20 0.44
MMP3 P08254 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
NR1H4 Q96RI1 1/20 0.41
CDC25B P30305 2/20 0.41
PTPN1 P18031 1/20 0.41
ALDH1A1 P00352 4/20 0.41
HPGD P15428 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CNR1 P21554 3/20 0.40
CNR2 P34972 3/20 0.40
KDM4E B2RXH2 3/20 0.40
TDP1 Q9NUW8 3/20 0.40
CYP2C9 P11712 2/20 0.40
GMNN O75496 2/20 0.40

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
SCHEMBL6516628 0.83 MMP12 (0.46) NR4A1NR4A2NR4A3KMT2ANR1H4
SCHEMBL6524366 0.82 NR4A1 (0.46) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL6514435 0.81 NR4A1 (0.47) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL6514446 0.81 NR4A1 (0.47) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL6520797 0.80 KMT2A (0.49) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL6520296 0.79 NR4A1 (0.43) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL6515935 0.77 KDM2B (0.44) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL6516699 0.77 NPC1 (0.44) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL6518030 0.77 PTPN1 (0.49) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL6523490 0.76 PTPN1 (0.51) NR4A1NR4A2NR4A3MEN1KMT2A

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-6958366-B2 Antifouling coating composition and novel resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-10-25 US disclosed