SCHEMBL22609175

SCHEMBL22609175

Cc1csc(-n2sc3ccccc3c2=O)n1.O=c1c2ccccc2sn1-c1nnc(-c2ccc(Br)cc2)s1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT2B Q92831 5/20 0.68
KAT2A Q92830 4/20 0.68
EP300 Q09472 3/20 0.68
MPI P34949 11/20 0.46
G6PD P11413 6/20 0.46
KDM4E B2RXH2 5/20 0.46
ALDH1A1 P00352 5/20 0.46
MAPT P10636 5/20 0.46
TDP1 Q9NUW8 5/20 0.46
HPGD P15428 4/20 0.46
ALOX12 P18054 4/20 0.46
APOBEC3G Q9HC16 4/20 0.46
MEN1 O00255 2/20 0.46
POLB P06746 2/20 0.46
ALOX15 P16050 2/20 0.46
KMT2A Q03164 2/20 0.46
HSD17B10 Q99714 2/20 0.46
TP53 P04637 2/20 0.46
CACNA1B Q00975 1/20 0.46
RUNX1 Q01196 1/20 0.46

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
SCHEMBL1903519 0.88 KAT2B (0.51) KAT2BKAT2AEP300MPIG6PD
SCHEMBL1897468 0.82 KAT2B (1.00) KAT2BKAT2AEP300MPIG6PD
SCHEMBL1905901 0.79 KAT2B (0.56) KAT2BKAT2AEP300MPIG6PD
SCHEMBL12297905 0.72 KAT2B (1.00) KAT2BKAT2AEP300MPIG6PD
SCHEMBL1904049 0.66 KAT2B (0.55) KAT2BKAT2AEP300MPIG6PD
SCHEMBL1906226 0.66 MPI (0.55) KAT2BKAT2AEP300MPIG6PD
SCHEMBL8371734 0.66 MPI (0.74) KAT2BMPIG6PDKDM4EALDH1A1
SCHEMBL1896492 0.66 KAT2B (0.65) KAT2BKAT2AEP300MPIG6PD
SCHEMBL1908012 0.63 KAT2B (0.54) KAT2BKAT2AEP300MPIG6PD
SCHEMBL21687131 0.62 KAT2B (1.00) KAT2BKAT2AEP300MPIG6PD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3732180-A1 COMBINED MODALITIES FOR NUCLEOSIDES AND/OR NADPH OXIDASE (NOX) INHIBITORS AS MYELOID-SPECIFIC ANTIVIRAL AGENTS Emory University (US) 2020-11-04 EP claimed
EP-4319764-A2 THIONUCLEOSIDES AS ANTIVIRAL AGENTS Emory University (US) 2024-02-14 EP disclosed
EP-4319762-A2 NUCLEOSIDES AND NUCLEOTIDES ANALOGS AS ANTIVIRAL AGENTS Emory University (US) 2024-02-14 EP disclosed
EP-4319763-A2 MODIFIED NUCLEOSIDES AND NUCLEOTIDES ANALOGS AS ANTIVIRAL AGENTS FOR CORONA AND OTHER VIRUSES Emory University (US) 2024-02-14 EP disclosed
WO-2022217155-A2 THIONUCLEOSIDES AS ANTIVIRAL AGENTS EMORY UNIVERSITY (US) 2022-10-13 WO disclosed
WO-2020247665-A1 PEPTIDOMIMETICS FOR THE TREATMENT OF CORONAVIRUS AND PICORNAVIRUS INFECTIONS EMORY UNIVERSITY (US) 2020-12-10 WO disclosed
EP-3732180-A1 COMBINED MODALITIES FOR NUCLEOSIDES AND/OR NADPH OXIDASE (NOX) INHIBITORS AS MYELOID-SPECIFIC ANTIVIRAL AGENTS Emory University (US) 2020-11-04 EP disclosed