SCHEMBL23219245

SCHEMBL23219245

CCOC(=O)Cc1ccccc1OCc1coc2c1cc(-c1ccnc(CN)c1F)c1occc12

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CFD P00746 12/20 0.50
DPP4 P27487 2/20 0.37
TBXAS1 P24557 1/20 0.37
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
USP2 O75604 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 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
SCHEMBL29852530 1.00 CFD (0.50) CFDDPP4TBXAS1MEN1POLB
SCHEMBL29853186 0.92 CFD (0.42) CFDDPP4TBXAS1MEN1POLB
SCHEMBL23229274 0.92 CFD (0.42) CFDDPP4TBXAS1MEN1POLB
SCHEMBL21437732 0.91 CFD (0.58) CFDDPP4TBXAS1MEN1POLB
SCHEMBL23218863 0.90 CFD (0.61) CFD
SCHEMBL29852776 0.90 CFD (0.61) CFD
SCHEMBL23219037 0.86 CFD (0.47) CFDDPP4TBXAS1MAPT
SCHEMBL29852433 0.86 CFD (0.47) CFDDPP4TBXAS1MAPT
SCHEMBL29852794 0.85 CFD (0.41) CFDTBXAS1MEN1POLBHPGD
SCHEMBL23217566 0.85 CFD (0.45) CFDDPP4TBXAS1MEN1POLB

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
WO-2021072198-A1 ORAL COMPLEMENT FACTOR D INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2021-04-15 WO disclosed
WO-2021072198-A1 ORAL COMPLEMENT FACTOR D INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2021-04-15 WO disclosed