SCHEMBL25262249

SCHEMBL25262249

O=c1cc(CCc2ccc(O)c(O)c2)oc2cccc(O)c12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 17/20 0.78
HTR3A P46098 1/20 0.75
HTR2C P28335 4/20 0.63

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
SCHEMBL25307093 0.87 HTR2B (0.63) HTR2BHTR3AHTR2C
SCHEMBL16972852 0.87 HTR2B (1.00) HTR2BHTR3AHTR2C
SCHEMBL18417922 0.86 HTR2B (1.00) HTR2BHTR3AHTR2C
SCHEMBL16972760 0.86 HTR2B (1.00) HTR2BHTR3AHTR2C
SCHEMBL18417920 0.85 HTR2B (0.60) HTR2BHTR3AHTR2C
SCHEMBL25843622 0.85 HTR2B (0.57) HTR2BHTR3AHTR2C
SCHEMBL16972779 0.80 HTR2B (0.74) HTR2BHTR3AHTR2C
SCHEMBL16972778 0.79 HTR2B (1.00) HTR2BHTR3AHTR2C
SCHEMBL16972791 0.78 HTR2B (0.95) HTR2BHTR3AHTR2C
SCHEMBL16972783 0.78 HTR2B (1.00) HTR2BHTR3AHTR2C

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-4215522-A1 DERIVATIVES OF 4-CHROMONE AS INHIBITORS OF THE RDRP POLYMERASE OF SARS-COV-2 VIRUS AND METHOD FOR THE PREPARATION THEREOF Fondazione Istituto Italiano di Tecnologia (IT) 2023-07-26 EP disclosed
EP-4215522-A1 DERIVATIVES OF 4-CHROMONE AS INHIBITORS OF THE RDRP POLYMERASE OF SARS-COV-2 VIRUS AND METHOD FOR THE PREPARATION THEREOF Fondazione Istituto Italiano di Tecnologia (IT) 2023-07-26 EP disclosed