SCHEMBL31489663

SCHEMBL31489663

Cc1cnc(Cl)nc1-c1cnn([C@H](c2ccc(F)cc2)C(C)(F)F)c1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 15/20 0.34
TYK2 P29597 9/20 0.34
JAK1 P23458 8/20 0.34
JAK3 P52333 7/20 0.34
FLT3 P36888 10/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.32
PDK1 Q15118 1/20 0.31
PDK2 Q15119 1/20 0.31
PDK3 Q15120 1/20 0.31
PDK4 Q16654 1/20 0.31
MAPK1 P28482 1/20 0.31
KDM4E B2RXH2 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
GPR55 Q9Y2T6 1/20 0.30

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
SCHEMBL31489235 0.90 CCNE2 (0.33) JAK2FLT3PTGDR2KDM4ESMN1; SMN2
SCHEMBL31489637 0.82 MKNK1 (0.39) JAK2TYK2JAK1JAK3MAPK1
SCHEMBL31489493 0.77 CREBBP (0.32) PTGDR2
SCHEMBL31489553 0.76 CYP11B2 (0.40) JAK2TYK2JAK1JAK3KDM4E
SCHEMBL31489816 0.76 CYP11B2 (0.40) JAK2TYK2JAK1JAK3KDM4E
SCHEMBL29425716 0.74 JAK2 (0.47) JAK2TYK2JAK1JAK3FLT3
SCHEMBL22852640 0.74 JAK2 (0.47) JAK2TYK2JAK1JAK3FLT3
SCHEMBL31489570 0.74 MKNK1 (0.40) JAK2TYK2JAK1JAK3MAPK1
SCHEMBL31489305 0.73 MKNK1 (0.38) JAK2TYK2JAK1JAK3KDM4E
SCHEMBL31489373 0.73 MKNK1 (0.38) JAK2TYK2JAK1JAK3KDM4E

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-2025072395-A1 TRIAZOLOPYRIDINYL COMPOUNDS AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2025-04-03 WO disclosed