SCHEMBL25452780

SCHEMBL25452780

Cc1ccc(CCCOc2cccc(CC(=O)Cc3ccccc3)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.56
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ DRD2 P14416 1/20 0.51
▸ DRD4 P21917 1/20 0.51
▸ DRD3 P35462 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ FFAR1 O14842 4/20 0.50
▸ PLA2G4B P0C869 1/20 0.48
▸ LTB4R Q15722 2/20 0.47
▸ LTB4R2 Q9NPC1 2/20 0.47
▸ PPARG P37231 1/20 0.47
▸ SLC2A1 P11166 1/20 0.47
▸ SIRT2 Q8IXJ6 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ EPHX2 P34913 1/20 0.46
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45

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
SCHEMBL25452779 0.85 MAOB (0.60) TDP1L3MBTL1FFAR1LTB4RLTB4R2
SCHEMBL3509948 0.77 PLA2G4B (0.54) FFAR1PLA2G4BPPARGSIRT2KDM4E
SCHEMBL13452328 0.77 HPGD (0.63) TDP1L3MBTL1DRD2DRD4DRD3
SCHEMBL11219229 0.77 L3MBTL1 (0.76) TDP1L3MBTL1MEN1KMT2A
SCHEMBL12031489 0.75 DRD2 (0.66) DRD2DRD4DRD3FFAR1MEN1
SCHEMBL9367360 0.75 FFAR1 (0.64) FFAR1PLA2G4BLTB4RLTB4R2SIRT2
SCHEMBL18798890 0.75 FFAR1 (0.60) DRD2DRD4DRD3FFAR1PPARG
SCHEMBL11621845 0.74 CTBP2 (0.63) L3MBTL1MEN1KMT2A
SCHEMBL15297882 0.74 MAOB (0.63) FFAR1PLA2G4BLTB4RLTB4R2PPARG
SCHEMBL3584817 0.74 MAOB (0.71) FFAR1MEN1KMT2A

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-20230144275-A1 THERMOSENSITIVE RECORDING MEDIUM NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2023-05-11 — — US disclosed
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