SCHEMBL9623652

SCHEMBL9623652

Oc1ccc(Oc2ccc(O)cc2Br)c(Br)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.58
ALDH1A1 P00352 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
MEN1 O00255 1/20 0.55
LMNA P02545 1/20 0.55
MAPT P10636 1/20 0.55
HPGD P15428 1/20 0.55
HTT P42858 1/20 0.55
KMT2A Q03164 1/20 0.55
ATM Q13315 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
ALOX15 P16050 6/20 0.52
TSHR P16473 1/20 0.50
ALOX12 P18054 2/20 0.46
AKR1B1 P15121 2/20 0.43
TTR P02766 1/20 0.41
ALOX5 P09917 1/20 0.40
PTGS2 P35354 1/20 0.40
MAOB P27338 1/20 0.38

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
SCHEMBL30298314 0.91 MAPK1 (0.75) MAPK1ALDH1A1TDP1L3MBTL1MEN1
SCHEMBL9623605 0.87 MEN1 (0.52) MAPK1ALDH1A1TDP1L3MBTL1MEN1
SCHEMBL29084757 0.83 MAPK1 (0.52) MAPK1ALDH1A1TDP1L3MBTL1MEN1
SCHEMBL28854441 0.83 LMNA (0.39) MAPK1ALDH1A1TDP1L3MBTL1MEN1
SCHEMBL12804866 0.83 MEN1 (0.39) MAPK1ALDH1A1TDP1L3MBTL1MEN1
SCHEMBL517614 0.81 ALOX5 (0.57) MAPK1ALDH1A1TDP1L3MBTL1MEN1
SCHEMBL29692497 0.81 ALOX5 (0.57) MAPK1ALDH1A1TDP1L3MBTL1MEN1
SCHEMBL13578679 0.81 MEN1 (0.38) MAPK1ALDH1A1TDP1L3MBTL1MEN1
SCHEMBL1581421 0.80 THRA (0.42) MAPK1ALDH1A1TDP1L3MBTL1MEN1
SCHEMBL11232859 0.79 MEN1 (0.41) MAPK1ALDH1A1TDP1L3MBTL1MEN1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0212944-B1 MELT-PROCESSABLE AROMATIC COPOLYESTER Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) 1992-04-08 EP disclosed
US-4746721-A ENGINEERING PLASTICS KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1988-05-24 US disclosed
EP-0212944-A2 Melt-processable aromatic copolyester Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) 1987-03-04 EP disclosed
EP-0165508-A2 Metal-containing phenolic coating compositons UNION CARBIDE CORPORATION (US) 1985-12-27 EP disclosed
US-4544688-A CORROSION INHIBITING COATINGS UNION CARBIDE CORP. (US) 1985-10-01 US disclosed