SCHEMBL25344174

SCHEMBL25344174

COc1ccc(Cl)cc1-n1ncc2c(Cl)ncnc21

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.58
PIP4K2A P48426 6/20 0.57
TP53 P04637 8/20 0.56
LMNA P02545 8/20 0.56
SLC2A1 P11166 2/20 0.49
SLC2A2 P11168 2/20 0.49
SLC2A3 P11169 2/20 0.49
PIK3CG P48736 1/20 0.44
PIP4K2C Q8TBX8 1/20 0.44

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
SCHEMBL25343885 0.90 PIP4K2A (0.54) MAPTPIP4K2ATP53LMNASLC2A1
SCHEMBL838951 0.84 SLC2A1 (0.65) MAPTTP53LMNASLC2A1SLC2A2
SCHEMBL25344401 0.82 SLC2A1 (0.47) MAPTPIP4K2ATP53LMNASLC2A1
SCHEMBL25344741 0.80 SLC2A1 (0.56) MAPTPIP4K2ATP53LMNASLC2A1
SCHEMBL839353 0.80 TP53 (0.48) MAPTPIP4K2ATP53LMNA
SCHEMBL25341841 0.75 SLC2A1 (0.42) MAPTPIP4K2ATP53LMNASLC2A1
SCHEMBL29096496 0.74 HTR3E (0.43) MAPTPIP4K2ATP53LMNA
SCHEMBL30639303 0.74 HTR3E (0.43) MAPTPIP4K2ATP53LMNA
SCHEMBL6268329 0.73 MAPT (0.64) MAPTPIP4K2ATP53LMNAPIK3CG
SCHEMBL11476904 0.73 RAB9A (0.63) MAPTTP53LMNA

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-4472739-A1 IMIDAZOLE MACROCYCLES FOR THE TREATMENT OF AUTOIMMUNE DISEASE F. Hoffmann-La Roche AG (CH) 2024-12-11 EP disclosed
WO-2023148129-A1 IMIDAZOLE MACROCYCLES FOR THE TREATMENT OF AUTOIMMUNE DISEASE F. HOFFMANN-LA ROCHE AG (CH) 2023-08-10 WO disclosed