SCHEMBL31000240

SCHEMBL31000240

COc1cc2ncc(-c3ccnc(Cl)n3)n2nc1C1CC(F)(F)C1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 3/20 0.39
▸ DYRK3 O43781 2/20 0.39
▸ DYRK2 Q92630 2/20 0.39
▸ CCNT1 O60563 1/20 0.39
▸ CDK9 P50750 1/20 0.39
▸ DYRK1B Q9Y463 1/20 0.39
▸ FYN P06241 12/20 0.35
▸ PDE4D Q08499 3/20 0.35
▸ GABRA1 P14867 1/20 0.33
▸ GABRG2 P18507 1/20 0.33
▸ GABRB3 P28472 1/20 0.33
▸ GABRA3 P34903 1/20 0.33

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
SCHEMBL31000343 0.89 DYRK1A (0.38) DYRK1ADYRK3DYRK2CCNT1CDK9
SCHEMBL31000324 0.86 DYRK1A (0.40) DYRK1ADYRK3DYRK2CCNT1CDK9
SCHEMBL31000221 0.82 DYRK1A (0.38) DYRK1ADYRK3DYRK2CCNT1CDK9
SCHEMBL31000208 0.81 DYRK1A (0.40) DYRK1ADYRK3DYRK2CCNT1CDK9
SCHEMBL31000237 0.81 TGFBR1 (0.32) —
SCHEMBL31000254 0.81 DYRK1A (0.40) DYRK1ADYRK3DYRK2CCNT1CDK9
SCHEMBL31000236 0.79 FYN (0.32) DYRK1ADYRK3DYRK2CCNT1CDK9
SCHEMBL31000177 0.78 PDE4D (0.39) DYRK1ADYRK3DYRK2CCNT1CDK9
SCHEMBL31000241 0.77 PDE4D (0.34) DYRK1ADYRK3DYRK2CCNT1CDK9
SCHEMBL31000244 0.75 TRPC6 (0.31) —

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
EP-4658659-A2 MULTI-CYCLIC IRAK AND FLT3 INHIBITING COMPOUNDS AND USES THEREOF Children's Hospital Medical Center (US) 2025-12-10 — — EP disclosed
WO-2024163764-A2 MULTI-CYCLIC IRAK AND FLT3 INHIBITING COMPOUNDS AND USES THEREOF CHILDREN'S HOSPITAL MEDICAL CENTER (US) 2024-08-08 — — WO disclosed
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