SCHEMBL29915216

SCHEMBL29915216

Oc1cc2nccc(Cl)c2cc1Br

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 2/20 0.39
MAPT P10636 5/20 0.38
AXL P30530 1/20 0.38
PRKCI P41743 1/20 0.38
GAA P10253 1/20 0.38
ATM Q13315 1/20 0.38
KDM4E B2RXH2 4/20 0.36
HSP90AA1 P07900 4/20 0.36
LMNA P02545 3/20 0.36
METAP2 P50579 2/20 0.36
METAP1 P53582 2/20 0.36
NR4A2 P43354 2/20 0.36
BRD4 O60885 1/20 0.36
SOS2 Q07890 1/20 0.36
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
TDP1 Q9NUW8 4/20 0.35
TP53 P04637 3/20 0.35
HTT P42858 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35

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
SCHEMBL12497089 1.00 TLR8 (0.39) TLR8MAPTAXLPRKCIGAA
SCHEMBL2748326 0.85 TLR8 (0.43) TLR8MAPTAXLPRKCIGAA
SCHEMBL29576809 0.85 TLR8 (0.43) TLR8MAPTAXLPRKCIGAA
SCHEMBL29487149 0.83 TLR8 (0.42) TLR8MAPTAXLPRKCIGAA
SCHEMBL22959954 0.83 TLR8 (0.42) TLR8MAPTAXLPRKCIGAA
SCHEMBL16636981 0.79 PRKCI (0.41) TLR8MAPTAXLPRKCIKDM4E
SCHEMBL18451242 0.79 KMT2A (0.39) TLR8MAPTGAAATMKDM4E
SCHEMBL16604815 0.79 TLR8 (0.39) TLR8MAPTAXLPRKCIKDM4E
SCHEMBL22959955 0.79 ESR1 (0.39) TLR8MAPTAXLPRKCIGAA
SCHEMBL15960732 0.79 TLR8 (0.52) TLR8MAPTAXLPRKCIGAA

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-4322947-A1 HETEROARYL COMPOUNDS AS INHIBITORS OF RIP2 KINASE, COMPOSITION AND APPLICATION THEREOF Accro Bioscience (HK) Limited (HK) 2024-02-21 EP disclosed
WO-2022192760-A1 HETEROARYL COMPOUNDS AS INHIBITORS OF RIP2 KINASE, COMPOSITION AND APPLICATION THEREOF ACCRO BIOSCIENCE (HK) LIMITED (CN) 2022-09-15 WO disclosed