SCHEMBL24833595

SCHEMBL24833595

Cc1nc(N2CCCC(N3CCN(C)C3=O)C2)ncc1C#N

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 15/20 0.43
▸ LCK P06239 14/20 0.43
▸ BTK Q06187 4/20 0.43
▸ GPBAR1 Q8TDU6 1/20 0.40
▸ EGFR P00533 7/20 0.39
▸ PIK3CD O00329 2/20 0.38
▸ PIK3R1 P27986 1/20 0.38
▸ KCNJ1 P48048 1/20 0.37

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
SCHEMBL30160648 0.89 JAK3 (0.42) JAK3LCKBTKGPBAR1EGFR
SCHEMBL24833599 0.89 JAK3 (0.42) JAK3LCKBTKGPBAR1EGFR
SCHEMBL24834042 0.77 KDM4E (0.39) JAK3LCKBTKEGFR
SCHEMBL31097402 0.76 JAK3 (0.37) JAK3LCKBTKEGFR
SCHEMBL30356545 0.76 JAK3 (0.48) JAK3LCKBTKEGFR
SCHEMBL31591131 0.74 JAK3 (0.42) JAK3LCKBTKEGFR
SCHEMBL16764192 0.74 JAK3 (0.53) JAK3LCKBTKEGFR
SCHEMBL29871862 0.74 JAK3 (0.53) JAK3LCKBTKEGFR
SCHEMBL16764194 0.74 JAK3 (0.53) JAK3LCKBTKEGFR
SCHEMBL30165821 0.74 JAK3 (0.54) JAK3LCKBTKEGFR

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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