SCHEMBL26089940

SCHEMBL26089940

COC(=O)c1[nH]c(CBr)nc1CBr

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 4/20 0.36
KDM4C Q9H3R0 1/20 0.35
ALDH1A1 P00352 6/20 0.33
KDM4E B2RXH2 5/20 0.33
HSD17B10 Q99714 4/20 0.32
ALOX15 P16050 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
RNASEH1 O60930 1/20 0.31
GAA P10253 3/20 0.31
MAPT P10636 2/20 0.31
USP2 O75604 1/20 0.31
HPGD P15428 1/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
PADI4 Q9UM07 1/20 0.31
GLA P06280 1/20 0.31
TSHR P16473 1/20 0.31
MMP2 P08253 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL8710553 0.83 NPSR1 (0.36) NPSR1KDM4CALDH1A1KDM4EHSD17B10
SCHEMBL23930812 0.83 NPSR1 (0.45) NPSR1KDM4CALDH1A1KDM4EHSD17B10
SCHEMBL7398766 0.73 HPGD (0.37) NPSR1KDM4CALDH1A1KDM4EMEN1
SCHEMBL8806965 0.73 IGF1R (0.39)
SCHEMBL9873189 0.71 GPR84 (0.37) ALDH1A1GAAMAPTLMNATSHR
SCHEMBL8811268 0.69 GPR84 (0.36) ALDH1A1
SCHEMBL25244034 0.69 KDM4E (0.41) KDM4CALDH1A1KDM4EMEN1KMT2A
SCHEMBL24283838 0.69 LMNA (0.37) NPSR1KDM4CALDH1A1HSD17B10HPGD
SCHEMBL8809735 0.68 GPR84 (0.41) MAPT
SCHEMBL23931077 0.68 LMNA (0.35) NPSR1KDM4CALDH1A1KDM4EHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023069547-A1 5-MEMBERED HETEROARYL CARBOXAMIDE COMPOUNDS FOR TREATMENT OF HBV ASSEMBLY BIOSCIENCES, INC. (US) 2023-04-27 WO disclosed