SCHEMBL25844447

SCHEMBL25844447

COc1cc2c3c(c4c(c2cc1OC)-c1ccc(C)cc1C4(C)C)C=CC(c1ccc(N2CCOCC2)cc1)(c1ccc(N2CCOCC2)cc1)O3

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 1/20 0.34
HIF1A Q16665 2/20 0.34
ALDH1A1 P00352 3/20 0.33
MAPT P10636 3/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
PKM P14618 1/20 0.33
TGFBR1 P36897 1/20 0.32
ACVR1 Q04771 1/20 0.32
LCK P06239 3/20 0.32
CHEK1 O14757 2/20 0.32
ACHE P22303 2/20 0.32
BACE1 P56817 1/20 0.32
KDM4E B2RXH2 2/20 0.31
HTT P42858 1/20 0.31
PIK3CA P42336 2/20 0.31
IL2 P60568 1/20 0.31
MAP4K1 Q92918 1/20 0.31
APP P05067 1/20 0.31
BCHE P06276 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
SCHEMBL25844451 0.97 ALK (0.33) ALKHIF1AALDH1A1MAPTMEN1
SCHEMBL25844449 0.97 MAPT (0.35) ALKHIF1AALDH1A1MAPTMEN1
SCHEMBL25844452 0.95 ALK (0.33) ALKHIF1AALDH1A1MAPTPKM
SCHEMBL25844455 0.93 ALDH1A1 (0.33) ALKALDH1A1MAPTMEN1KMT2A
SCHEMBL25844458 0.93 PIK3CA (0.32) ALKALDH1A1MAPTPKMHTT
SCHEMBL25844587 0.91 MEN1 (0.34) HIF1AALDH1A1MAPTMEN1KMT2A
SCHEMBL25844702 0.90 ALK (0.35) ALKALDH1A1MAPTMEN1KMT2A
SCHEMBL25605055 0.90 STK10 (0.36) HIF1AALDH1A1MAPTMEN1KMT2A
SCHEMBL15763099 0.90 PRKDC (0.32) ALDH1A1MAPTMEN1KMT2APKM
SCHEMBL25849395 0.90 TNIK (0.34) HIF1AALDH1A1MAPTMEN1KMT2A

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