SCHEMBL24388357

SCHEMBL24388357

C=CC(=O)Nc1ccc(F)c(Nc2nc(Nc3cnn(C)c3)ncc2-c2ccc(F)c(F)c2)c1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 9/20 0.57
▸ JAK1 P23458 3/20 0.51
▸ JAK2 O60674 2/20 0.51
▸ TTK P33981 1/20 0.51
▸ BTK Q06187 2/20 0.51
▸ MAP3K7 O43318 5/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ MAP2K1 Q02750 1/20 0.47
▸ FGFR1 P11362 4/20 0.46
▸ SRC P12931 4/20 0.46
▸ EGFR P00533 6/20 0.46
▸ ITK Q08881 3/20 0.46

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
SCHEMBL29507977 1.00 JAK3 (0.57) JAK3JAK1JAK2TTKBTK
SCHEMBL29508001 0.94 JAK3 (0.55) JAK3JAK1JAK2TTKBTK
SCHEMBL24388369 0.94 JAK3 (0.55) JAK3JAK1JAK2TTKBTK
SCHEMBL29508032 0.94 JAK3 (0.60) JAK3JAK1JAK2TTKBTK
SCHEMBL24388367 0.94 JAK3 (0.60) JAK3JAK1JAK2TTKBTK
SCHEMBL29508010 0.94 JAK3 (0.54) JAK3JAK1JAK2TTKBTK
SCHEMBL24388610 0.94 JAK3 (0.54) JAK3JAK1JAK2TTKBTK
SCHEMBL24392983 0.94 JAK3 (0.56) JAK3JAK1JAK2TTKBTK
SCHEMBL24388530 0.93 JAK3 (0.57) JAK3JAK1JAK2TTKBTK
SCHEMBL24392856 0.93 JAK3 (0.57) JAK3JAK1JAK2TTKBTK

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
CN-116710444-A Pyrimidine compounds, compositions and pharmaceutical uses thereof 缆图药品公司 2023-09-05 — — CN disclosed
WO-2022094355-A1 PYRIMIDINE COMPOUNDS, COMPOSITIONS, AND MEDICINAL APPLICATIONS THEREOF LENGO THERAPEUTICS, INC. (US) 2022-05-05 — — WO disclosed
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