SCHEMBL28980992

SCHEMBL28980992

C=CC(=O)Nc1ccc(Nc2nc(Nc3ccc(N4CCN(C)CC4)cc3)ncc2F)cc1

nearest known ligand 0.72

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.72
EGFR P00533 6/20 0.66
FLT3 P36888 2/20 0.66
BLK P51451 2/20 0.66
MAP3K7 O43318 5/20 0.66
SRC P12931 4/20 0.66
MAP2K1 Q02750 3/20 0.66
MAPK1 P28482 2/20 0.66
FGFR1 P11362 2/20 0.66
BTK Q06187 3/20 0.62
JAK3 P52333 3/20 0.61
TEC P42680 1/20 0.61
SLK Q9H2G2 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.59
JAK2 O60674 1/20 0.59
BMX P51813 1/20 0.59
ITK Q08881 1/20 0.59
SYK P43405 1/20 0.59

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
SCHEMBL28980983 0.93 EGFR (0.72) BRD4EGFRBLKSRCBTK
SCHEMBL31684784 0.93 EGFR (0.72) BRD4EGFRBLKSRCBTK
SCHEMBL28981015 0.90 JAK3 (0.69) BRD4EGFRFLT3BLKMAP3K7
SCHEMBL28980984 0.90 SRC (0.82) BRD4FLT3MAP3K7SRCMAP2K1
SCHEMBL28980965 0.89 MAP3K7 (0.81) BRD4EGFRFLT3BLKMAP3K7
SCHEMBL28980990 0.89 SRC (0.69) BRD4EGFRFLT3BLKMAP3K7
SCHEMBL28981003 0.89 JAK3 (0.60) BRD4EGFRFLT3BLKMAP3K7
SCHEMBL28980985 0.87 MAP3K7 (0.71) BRD4EGFRFLT3BLKMAP3K7
SCHEMBL28981021 0.86 SRC (0.67) BRD4FLT3MAP3K7SRCMAP2K1
SCHEMBL17526046 0.84 BRD4 (1.00) BRD4EGFRFLT3BTKJAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4617261-A1 2,4,5-TRISUBSTITUTED PYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF Wenzhou Medical University (CN) 2025-09-17 EP claimed
CN-115894381-A 2,4,5-trisubstituted pyrimidine compound and preparation method and application thereof 温州医科大学 2023-04-04 CN claimed
EP-4617261-A1 2,4,5-TRISUBSTITUTED PYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF Wenzhou Medical University (CN) 2025-09-17 EP disclosed
CN-115894381-A 2,4,5-trisubstituted pyrimidine compound and preparation method and application thereof 温州医科大学 2023-04-04 CN disclosed