SCHEMBL24833040

SCHEMBL24833040

NC(=O)c1ncc(N2CCCC(N3CCN(C4COC4)C3=O)C2)nc1Nc1ccc(N2CCC3(CC2)CC(N2CCN(c4ccc5c(c4)C(=O)N(C4CCC(=O)NC4=O)C5=O)CC2)C3)cc1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 9/20 0.56
▸ JAK3 P52333 19/20 0.53
▸ LCK P06239 17/20 0.53
▸ EGFR P00533 8/20 0.53

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
SCHEMBL24832958 0.95 BTK (0.58) BTKJAK3LCKEGFR
SCHEMBL24833036 0.95 BTK (0.59) BTKJAK3LCKEGFR
SCHEMBL24833188 0.94 BTK (0.61) BTKJAK3LCKEGFR
SCHEMBL30160906 0.92 BTK (0.59) BTKJAK3LCKEGFR
SCHEMBL27175862 0.90 BTK (0.52) BTKJAK3LCKEGFR
SCHEMBL24833192 0.89 BTK (0.66) BTKJAK3LCKEGFR
SCHEMBL24833212 0.89 JAK3 (0.65) BTKJAK3LCKEGFR
SCHEMBL24832933 0.89 JAK3 (0.67) BTKJAK3LCKEGFR
SCHEMBL23594532 0.88 JAK3 (0.62) BTKJAK3LCKEGFR
SCHEMBL21946862 0.87 JAK3 (0.64) 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-2023274390-A1 BRUTON'S TYROSINE KINASE AND MUTANT DEGRADER, COMPOSITION AND APPLICATION THEREOF 杭州和正医药有限公司 2023-01-05 — — WO disclosed
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