SCHEMBL27399102

SCHEMBL27399102

Cc1cnc2ccc(-c3ncc(Cl)n3-c3ccc(F)cc3)cn12

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 4/20 0.39
PTGS2 P35354 2/20 0.39
ADORA2A P29274 8/20 0.39
ADORA1 P30542 8/20 0.39
ADORA2B P29275 5/20 0.39
FLT3 P36888 3/20 0.37
GRM2 Q14416 2/20 0.37
PIK3CA P42336 1/20 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
SCHEMBL27399107 0.86 PTGS2 (0.36) TGFBR1PTGS2FLT3PIK3CA
SCHEMBL27399097 0.78 TGFBR1 (0.47) TGFBR1PTGS2GRM2PIK3CA
SCHEMBL14041215 0.76 TGFBR1 (0.43) TGFBR1ADORA2AADORA1ADORA2BFLT3
SCHEMBL31051205 0.75 TGFBR1 (0.41) TGFBR1PTGS2FLT3PIK3CA
SCHEMBL31051278 0.73 FLT3 (0.36) TGFBR1PTGS2ADORA2AADORA1ADORA2B
SCHEMBL27399217 0.73 ADORA2A (0.47) TGFBR1ADORA2AADORA1ADORA2B
SCHEMBL27399088 0.72 PTGS2 (0.54) TGFBR1PTGS2ADORA2AADORA1ADORA2B
SCHEMBL27398657 0.71 FLT3 (0.39) TGFBR1ADORA2AADORA1ADORA2BFLT3
SCHEMBL24155891 0.68 ADORA2A (0.44) TGFBR1ADORA2AADORA1ADORA2BFLT3
SCHEMBL27399170 0.68 TGFBR1 (0.43) TGFBR1ADORA2AADORA1ADORA2B

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-2024126404-A1 IMIDAZO[1,2-A]PYRIDINE DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2024-06-20 WO disclosed