SCHEMBL5208220

SCHEMBL5208220

CCCOc1c(OC)cc(OB(O)O)cc1OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.48
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 1/20 0.47
HPGD P15428 1/20 0.47
HTT P42858 1/20 0.47
KMT2A Q03164 1/20 0.47
MAPT P10636 1/20 0.45
RAB9A P51151 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
TUBB4A P04350 1/20 0.43
TUBB P07437 1/20 0.43
TUBA3C P0DPH7 1/20 0.43
TUBA1B P68363 1/20 0.43
TUBA4A P68366 1/20 0.43
TUBB4B P68371 1/20 0.43
TUBB3 Q13509 1/20 0.43
TUBB2A Q13885 1/20 0.43
TUBB8 Q3ZCM7 1/20 0.43
TUBA3E Q6PEY2 1/20 0.43
TUBA1A Q71U36 1/20 0.43

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
SCHEMBL5203576 0.87 TNFRSF1A (0.45) SMN1; SMN2ALDH1A1MEN1HPGDHTT
SCHEMBL5205549 0.86 HTR2A (0.49) SMN1; SMN2ALDH1A1MAPTTUBB4ATUBB
SCHEMBL5207796 0.80 CYP3A4 (0.52) MEN1KMT2AMAPTTUBB4ATUBB
SCHEMBL6341314 0.79 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1MEN1HPGDHTT
SCHEMBL5203497 0.78 CYP2C9 (0.35) ALDH1A1MEN1KMT2AMAPTL3MBTL1
SCHEMBL5205311 0.77 MAPK1 (0.35) SMN1; SMN2ALDH1A1MEN1HPGDHTT
SCHEMBL5208870 0.75 TSHR (0.49) SMN1; SMN2ALDH1A1MEN1HTTKMT2A
SCHEMBL5203822 0.75 GAA (0.48) ALDH1A1MEN1HPGDKMT2AMAPT
SCHEMBL5205439 0.75 TNFRSF1A (0.51) SMN1; SMN2RAB9ATUBB4ATUBBTUBA3C
SCHEMBL7922019 0.75 MAPT (0.45) SMN1; SMN2ALDH1A1MEN1HPGDHTT

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
EP-1403251-B1 BIS(2-ARYL-5-PYRIDYL) DERIVATIVE KOWA CO (JP) 2007-07-18 EP disclosed
EP-1403251-A1 BIS(2-ARYL-5-PYRIDYL) DERIVATIVE Kowa Co., Ltd. (JP) 2004-03-31 EP disclosed