SCHEMBL23217611

SCHEMBL23217611

CCOC(=O)Cc1ccccc1OC(C)c1cc(Br)c2occc2c1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 1/20 0.38
CFD P00746 7/20 0.36
PKM P14618 1/20 0.35
HPGD P15428 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.32
PRMT5 O14744 1/20 0.32
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL30010940 1.00 TBXAS1 (0.38) TBXAS1CFDPKMHPGDKDM4E
SCHEMBL29672991 0.89 HPGD (0.40) TBXAS1CFDPKMHPGDKDM4E
SCHEMBL23217708 0.89 HPGD (0.40) TBXAS1CFDPKMHPGDKDM4E
SCHEMBL23217589 0.88 CFD (0.46) CFD
SCHEMBL23217814 0.87 CFD (0.36) TBXAS1CFDPKMHPGDKDM4E
Hexane SCHEMBL23217870 0.86 HPGD (0.38) TBXAS1CFDPKMHPGDKDM4E
SCHEMBL23217676 0.84 L3MBTL1 (0.35) TBXAS1CFDPKMHPGDKDM4E
SCHEMBL23217702 0.83 CFD (0.49) CFD
SCHEMBL30010509 0.83 CFD (0.49) CFD
SCHEMBL30010562 0.83 TBXAS1 (0.33) TBXAS1CFDPKMHPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4041717-A1 ORAL COMPLEMENT FACTOR D INHIBITORS Biocryst Pharmaceuticals, Inc. (US) 2022-08-17 EP disclosed
CN-114555570-A Oral complement factor D inhibitors 拜奥克里斯特制药公司 2022-05-27 CN disclosed
WO-2021072156-A1 ORAL COMPLEMENT FACTOR D INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2021-04-15 WO disclosed
WO-2021072156-A1 ORAL COMPLEMENT FACTOR D INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2021-04-15 WO disclosed