SCHEMBL26032641

SCHEMBL26032641

CC(=O)CCC(=O)OCCOc1ccc(C2(c3ccc(N4CCOCC4)cc3)C=Cc3c4c(c5ccc(C)cc5c3O2)-c2ccccc2C42CCCCCCC2)cc1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
TSHR P16473 1/20 0.33
PLA2G4A P47712 1/20 0.32
MRGPRX4 Q96LA9 1/20 0.31
GAA P10253 2/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
MC4R P32245 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30
PTK2B Q14289 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL24678318 0.89 MAPT (0.33) MAPTTSHRPLA2G4AMRGPRX4MEN1
SCHEMBL21636946 0.88 MEN1 (0.33) MAPTSMN1; SMN2PLA2G4AMRGPRX4MEN1
SCHEMBL26032663 0.87
SCHEMBL24605037 0.85 MAPT (0.33) MAPTSMN1; SMN2TSHRPLA2G4AGAA
SCHEMBL24605093 0.85 MAPT (0.33) MAPTSMN1; SMN2TSHRPLA2G4AGAA
SCHEMBL26032673 0.85 MAPT (0.34) MAPTSMN1; SMN2TSHRPLA2G4AMRGPRX4
SCHEMBL27393177 0.85 AKT1 (0.34) MAPTSMN1; SMN2TSHRMEN1KMT2A
SCHEMBL24605092 0.84 MAPT (0.33) MAPTSMN1; SMN2TSHRMRGPRX4GAA
SCHEMBL26327926 0.84 SIRT3 (0.31) MAPTL3MBTL1
SCHEMBL25090645 0.83 MAPT (0.35) MAPTSMN1; SMN2TSHRPLA2G4AMRGPRX4

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-20230242809-A1 PHOTOCHROMIC HYDROXYURETHANE COMPOUND TOKUYAMA CORPORATION (JP) 2023-08-03 US disclosed