SCHEMBL30944809

SCHEMBL30944809

ClCc1ccn2c(-c3ccccc3)c(-c3ccccn3)nc2c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 6/20 0.49
AKT2 P31751 6/20 0.49
GAA P10253 5/20 0.44
HTT P42858 4/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
KMT2A Q03164 3/20 0.44
NPSR1 Q6W5P4 3/20 0.44
TDP1 Q9NUW8 3/20 0.44
MITF O75030 1/20 0.44
MAPT P10636 3/20 0.41
POLB P06746 1/20 0.41
TP53 P04637 2/20 0.40
PTGS2 P35354 1/20 0.40
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
GFER P55789 1/20 0.39

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
SCHEMBL30944799 0.89 AKT1 (0.42) AKT1AKT2GAAHTTSMN1; SMN2
SCHEMBL30944802 0.89 AKT1 (0.42) AKT1AKT2GAAHTTSMN1; SMN2
SCHEMBL30944798 0.88 AKT1 (0.56) AKT1AKT2GAAHTTSMN1; SMN2
SCHEMBL30944793 0.83 HTR2C (0.42) AKT1AKT2GAAHTTSMN1; SMN2
SCHEMBL30944790 0.82 GAA (0.40) AKT1AKT2GAAHTTSMN1; SMN2
SCHEMBL13382207 0.79 PTGS2 (0.60) AKT1AKT2GAAHTTSMN1; SMN2
SCHEMBL25767725 0.73 PTGS2 (0.57) AKT1AKT2GAAHTTSMN1; SMN2
SCHEMBL30944792 0.73 TGFBR1 (0.38) AKT1AKT2
SCHEMBL25767722 0.73 PTGS2 (0.53) AKT1AKT2GAAHTTSMN1; SMN2
SCHEMBL25767719 0.72 PTGS2 (0.52) AKT1AKT2GAAHTTSMN1; SMN2

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-4626896-A1 POLYELECTROPHILIC METALATED HETEROCYCLES DERIVED FROM 2-(PYRIDIN-2-YL)IMIDAZO[1,2-A]PYRIDINE AND USE THEREOF AS CHEMOTHERAPEUTIC AGENTS Universidad del País Vasco/Euskal Herriko Unibertsitatea (ES) 2025-10-08 EP disclosed
WO-2024115550-A1 POLYELECTROPHILIC METALATED HETEROCYCLES DERIVED FROM 2-(PYRIDIN-2-YL)IMIDAZO[1,2-A]PYRIDINE AND USE THEREOF AS CHEMOTHERAPEUTIC AGENTS UNIVERSIDAD DEL PAÍS VASCO/EUSKAL HERRIKO UNIBERTSITATEA (ES) 2024-06-06 WO disclosed