SCHEMBL25607964

SCHEMBL25607964

CCNC(C)Nc1nc(N2CCCCC2)cnc1C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 17/20 0.42
▸ JAK3 P52333 11/20 0.42
▸ LCK P06239 10/20 0.42
▸ EGFR P00533 5/20 0.42

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
SCHEMBL25608245 0.88 BTK (0.46) BTKJAK3LCKEGFR
SCHEMBL25607783 0.81 JAK3 (0.40) BTKJAK3LCKEGFR
SCHEMBL25608157 0.78 BTK (0.41) BTKJAK3LCKEGFR
SCHEMBL25607781 0.77 BTK (0.49) BTKJAK3LCKEGFR
SCHEMBL18884634 0.76 BTK (0.62) BTKJAK3LCKEGFR
SCHEMBL25649437 0.74 JAK3 (0.57) BTKJAK3LCKEGFR
SCHEMBL18884639 0.74 BTK (0.70) BTKJAK3LCKEGFR
SCHEMBL18884592 0.74 BTK (0.64) BTKJAK3LCKEGFR
SCHEMBL18296116 0.74 BTK (0.54) BTKJAK3LCKEGFR
SCHEMBL18884581 0.73 BTK (0.66) BTKJAK3LCKEGFR

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-2023088406-A1 FUSED IMIDE DERIVATIVE 正大天晴药业集团股份有限公司 2023-05-25 — — WO disclosed
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