SCHEMBL10740109

SCHEMBL10740109

COC(=O)[C@H](O)[C@H](OCc1ccccc1)[C@@H](OCc1ccccc1)[C@@H](C=O)OCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.45
SLC1A3 P43003 2/20 0.40
SLC1A2 P43004 2/20 0.40
SLC1A1 P43005 2/20 0.40
KMT2A Q03164 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CTSB P07858 2/20 0.39
MIF P14174 1/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
MAPT P10636 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
RCE1 Q9Y256 1/20 0.37

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
SCHEMBL10509257 1.00 LTA4H (0.45) LTA4HSLC1A3SLC1A2SLC1A1KMT2A
SCHEMBL10511795 1.00 LTA4H (0.45) LTA4HSLC1A3SLC1A2SLC1A1KMT2A
SCHEMBL10511562 1.00 LTA4H (0.45) LTA4HSLC1A3SLC1A2SLC1A1KMT2A
SCHEMBL6231965 0.89 LTA4H (0.43) LTA4HSLC1A3SLC1A2SLC1A1KMT2A
SCHEMBL18045628 0.85 LTA4H (0.46) LTA4HSLC1A3SLC1A2SLC1A1KMT2A
SCHEMBL10508832 0.84 SLC1A3 (0.46) LTA4HSLC1A3SLC1A2SLC1A1KMT2A
SCHEMBL10510398 0.84 SLC1A3 (0.46) LTA4HSLC1A3SLC1A2SLC1A1KMT2A
SCHEMBL10507064 0.84 SLC1A3 (0.46) LTA4HSLC1A3SLC1A2SLC1A1KMT2A
SCHEMBL10510304 0.84 SLC1A3 (0.46) LTA4HSLC1A3SLC1A2SLC1A1KMT2A
SCHEMBL10511826 0.84 SLC1A3 (0.46) LTA4HSLC1A3SLC1A2SLC1A1KMT2A

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-4698423-A ANTITUMOR AGENTS SUNTORY LIMITED (JP) 1987-10-06 US disclosed
EP-0173462-A2 Ellipticine derivative and production process thereof SUNTORY LIMITED (JP) 1986-03-05 EP disclosed