SCHEMBL30203231

SCHEMBL30203231

OB(O)c1cc2ccc3cccc4ccc(c1B(O)O)c2c34

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.47
ERBB2 P04626 1/20 0.47
FYN P06241 1/20 0.47
MAOA P21397 1/20 0.47
ACHE P22303 1/20 0.47
AHR P35869 1/20 0.47
ALDH1A1 P00352 6/20 0.46
HPGD P15428 5/20 0.46
HSD17B10 Q99714 4/20 0.46
CYP3A4 P08684 2/20 0.46
TSHR P16473 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
KDM4E B2RXH2 4/20 0.40
MAPT P10636 1/20 0.40
CYP1A1 P04798 2/20 0.39
CYP1B1 Q16678 2/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
THRB P10828 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
SCHEMBL633807 1.00 CYP1A2 (0.47) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL13080593 0.85 CYP1A2 (0.53) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL224652 0.79 ALDH1A1 (0.54) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL29840683 0.79 ALDH1A1 (0.54) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL12431985 0.74 CYP1A2 (0.34) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL31150378 0.74 CYP1A2 (0.34) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL1816279 0.73 ALDH1A1 (0.54) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL5162965 0.71 CYP1A2 (0.47) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL1816278 0.70 CYP1A2 (0.65) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL31544308 0.70 ALDH1A1 (0.44) CYP1A2ERBB2FYNMAOAACHE

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
EP-2992947-B1 METHOD FOR THE PREPARATION OF MICROPOROUS ORGANIC MEMBRANES, MICROPOROUS ORGANIC MEMBRANES AND USE OF SAME KARLSRUHER INST TECHNOLOGIE (DE) 2023-03-01 EP disclosed