SCHEMBL31489305

SCHEMBL31489305

Fc1ccc([C@@H](n2cc(-c3ccnc(Cl)n3)cn2)C(F)(F)F)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 1/20 0.38
GABRA1 P14867 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA3 P34903 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.34
KDM4E B2RXH2 1/20 0.34
DYRK1B Q9Y463 3/20 0.34
MAPT P10636 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
JAK2 O60674 4/20 0.31
JAK1 P23458 3/20 0.31
TYK2 P29597 3/20 0.31
JAK3 P52333 3/20 0.31
LRRK2 Q5S007 1/20 0.31

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
SCHEMBL31489373 1.00 MKNK1 (0.38) MKNK1GABRA1GABRG2GABRB3GABRA3
SCHEMBL31489637 0.91 MKNK1 (0.39) MKNK1GABRA1GABRG2GABRB3GABRA3
SCHEMBL31489570 0.89 MKNK1 (0.40) MKNK1GABRA1GABRG2GABRB3GABRA3
SCHEMBL31489233 0.83 MKNK1 (0.39) MKNK1GABRA1GABRG2GABRB3GABRA3
SCHEMBL31489513 0.80 MKNK1 (0.40) MKNK1GABRA1GABRG2GABRB3GABRA3
SCHEMBL31489488 0.79 MKNK1 (0.39) MKNK1GABRA1GABRG2GABRB3GABRA3
SCHEMBL19555915 0.78 MKNK1 (0.37) MKNK1GABRA1GABRG2GABRB3GABRA3
SCHEMBL31489235 0.74 CCNE2 (0.33) SMN1; SMN2KDM4EJAK2GPR55
SCHEMBL31489663 0.73 JAK2 (0.34) SMN1; SMN2KDM4EJAK2JAK1TYK2
SCHEMBL31489553 0.72 CYP11B2 (0.40) SMN1; SMN2KDM4EJAK2JAK1TYK2

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