SCHEMBL29467232

SCHEMBL29467232

COc1cccc(F)c1-c1c(OC)ccc2ccccc12

nearest known ligand 0.73

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.73
KMT2A Q03164 3/20 0.55
MEN1 O00255 2/20 0.55
ALDH1A1 P00352 1/20 0.55
RAB9A P51151 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
NISCH Q9Y2I1 1/20 0.49
NQO1 P15559 1/20 0.47
BCHE P06276 2/20 0.47
ACHE P22303 2/20 0.47
RPS6KA2 Q15349 6/20 0.45
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43
NFE2L2 Q16236 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SYK P43405 1/20 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
SCHEMBL23581961 1.00 MAPT (0.73) MAPTKMT2AMEN1ALDH1A1RAB9A
SCHEMBL24758934 0.88 MAPT (0.65) MAPTKMT2AMEN1ALDH1A1RAB9A
SCHEMBL22534454 0.88 MAPT (0.88) MAPTKMT2AMEN1ALDH1A1RAB9A
SCHEMBL31336201 0.88 MAPT (0.88) MAPTKMT2AMEN1ALDH1A1RAB9A
SCHEMBL29428410 0.86 MAPT (1.00) MAPTKMT2AMEN1ALDH1A1RAB9A
SCHEMBL998182 0.86 MAPT (1.00) MAPTKMT2AMEN1ALDH1A1RAB9A
SCHEMBL9950862 0.83 MAPT (0.68) MAPTKMT2AMEN1ALDH1A1RAB9A
SCHEMBL31010719 0.79 MAPT (0.66) MAPTKMT2AMEN1ALDH1A1RAB9A
SCHEMBL22658238 0.79 MAPT (0.66) MAPTKMT2AMEN1ALDH1A1RAB9A
SCHEMBL19082468 0.78 MAPT (0.54) MAPTKMT2AMEN1ALDH1A1RAB9A

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
CN-114207862-A Organic electroluminescent element, composition, powder, electronic device, and novel compound 出光兴产株式会社 2022-03-18 CN disclosed