SCHEMBL25844449

SCHEMBL25844449

COc1ccc(C2(c3ccc(N4CCOCC4)cc3)C=Cc3c4c(c5cc(OC)c(OC)cc5c3O2)-c2ccc(C)cc2C4(C)C)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.35
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 3/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
LCK P06239 3/20 0.33
ALK Q9UM73 1/20 0.33
PIK3CA P42336 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
HIF1A Q16665 1/20 0.32
CSF1R P07333 1/20 0.32
ADAM17 P78536 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
PKM P14618 1/20 0.31
PRKDC P78527 1/20 0.31

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
SCHEMBL25844447 0.97 ALK (0.34) MAPTKDM4EALDH1A1HTTKMT2A
SCHEMBL25844455 0.96 ALDH1A1 (0.33) MAPTKDM4EALDH1A1HTTKMT2A
SCHEMBL25844587 0.94 MEN1 (0.34) MAPTKDM4EALDH1A1HTTKMT2A
SCHEMBL25844451 0.94 ALK (0.33) MAPTKDM4EALDH1A1HTTKMT2A
SCHEMBL15763099 0.93 PRKDC (0.32) MAPTALDH1A1HTTKMT2AMEN1
SCHEMBL25844700 0.93 ALK (0.34) MAPTKDM4EALDH1A1HTTKMT2A
SCHEMBL25844452 0.92 ALK (0.33) MAPTALDH1A1HTTALKPIK3CA
SCHEMBL25844702 0.92 ALK (0.35) MAPTKDM4EALDH1A1HTTKMT2A
SCHEMBL25844140 0.92 AKT1 (0.33) MAPTKDM4EALDH1A1HTTKMT2A
SCHEMBL13868743 0.91 MAPT (0.35) MAPTKDM4EALDH1A1HTTKMT2A

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
US-20230227717-A1 PHOTOCHROMIC COMPOSITION, PHOTOCHROMIC ARTICLE, AND SPECTACLES HOYA LENS THAILAND LTD. (TH) 2023-07-20 US disclosed