SCHEMBL22005275

SCHEMBL22005275

C#CC(O)(c1ccc(OC)cc1)c1ccc(OCCCO)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAPT P10636 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
APP P05067 2/20 0.39
FDPS P14324 1/20 0.39
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
DRD2 P14416 1/20 0.38
DRD4 P21917 1/20 0.38
DRD3 P35462 1/20 0.38
ALDH1A1 P00352 1/20 0.38
PPARA Q07869 1/20 0.37
KCNH2 Q12809 1/20 0.37
AOC3 Q16853 1/20 0.37
ESRRG P62508 1/20 0.37
LMNA P02545 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CYP2C9 P11712 1/20 0.36

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
SCHEMBL1815976 0.93 CYP3A4 (0.49) CYP3A4SMN1; SMN2MAPTTDP1L3MBTL1
SCHEMBL1818269 0.90 AHR (0.43) SMN1; SMN2MAPTTDP1L3MBTL1FDPS
SCHEMBL28370253 0.90 AHR (0.43) SMN1; SMN2MAPTTDP1L3MBTL1FDPS
SCHEMBL28673732 0.87 APP (0.46) CYP3A4SMN1; SMN2MAPTL3MBTL1APP
SCHEMBL15948906 0.87 LMNA (0.44) SMN1; SMN2MAPTL3MBTL1MTNR1AMTNR1B
SCHEMBL25954061 0.84 ELANE (0.46) SMN1; SMN2MAPTTDP1APPALDH1A1
SCHEMBL164160 0.84 ELANE (0.46) SMN1; SMN2MAPTTDP1APPALDH1A1
SCHEMBL22113474 0.83 ALDH1A1 (0.47) SMN1; SMN2MAPTTDP1ALDH1A1AOC3
SCHEMBL10262594 0.83 LTA4H (0.47) CYP3A4SMN1; SMN2ALDH1A1LMNATSHR
SCHEMBL24403990 0.82 MAPT (0.39) SMN1; SMN2MAPTTDP1L3MBTL1FDPS

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3653615-B1 CHROMENE COMPOUND, CURABLE COMPOSITION COMPRISING SAME, AND OPTICAL ARTICLE COMPRISING CURED PRODUCT FORMED OF CURABLE COMPOSITION TOKUYAMA CORP (JP) 2023-03-01 EP disclosed
EP-3653615-A1 CHROMENE COMPOUND, CURABLE COMPOSITION COMPRISING SAME, AND OPTICAL ARTICLE COMPRISING CURED PRODUCT FORMED OF CURABLE COMPOSITION Tokuyama Corporation (JP) 2020-05-20 EP disclosed