SCHEMBL25595883

SCHEMBL25595883

NC(=O)c1ncc(N2CCCCC2)nc1Nc1ccc2c(c1)CNCC2

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 1/20 0.50
▸ LCK P06239 11/20 0.47
▸ BTK Q06187 11/20 0.47
▸ JAK3 P52333 12/20 0.46
▸ EGFR P00533 6/20 0.46
▸ IGF1R P08069 1/20 0.45

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
SCHEMBL24891043 0.96 LCK (0.47) SYKLCKBTKJAK3EGFR
SCHEMBL25593539 0.92 BTK (0.49) LCKBTKJAK3EGFR
SCHEMBL25593537 0.84 LCK (0.55) SYKLCKBTKJAK3EGFR
SCHEMBL25593403 0.83 LCK (0.55) SYKLCKBTKJAK3EGFR
SCHEMBL25593916 0.83 JAK3 (0.72) LCKBTKJAK3EGFR
SCHEMBL24833229 0.81 JAK3 (0.64) LCKBTKJAK3EGFR
SCHEMBL21947753 0.81 JAK3 (0.47) LCKBTKJAK3EGFR
SCHEMBL30195945 0.81 JAK3 (0.47) LCKBTKJAK3EGFR
SCHEMBL21946277 0.79 JAK3 (0.72) LCKBTKJAK3EGFR
SCHEMBL31039897 0.79 JAK3 (0.72) LCKBTKJAK3EGFR

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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