SCHEMBL22541280

SCHEMBL22541280

CC(=O)NCC(=O)NCC1CCN(C(=O)C2CCN(Cc3ccc(-n4c(O)nnc4-c4cc(C(C)C)c(O)cc4O)cc3)CC2)C1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 15/20 0.38
▸ CCR2 P41597 2/20 0.37
▸ HSP90AB1 P08238 5/20 0.37
▸ PDK1 Q15118 1/20 0.37
▸ BRD4 O60885 2/20 0.36
▸ CCR3 P51677 1/20 0.36
▸ HSP90B1 P14625 2/20 0.36
▸ TRAP1 Q12931 2/20 0.36

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
SCHEMBL22548154 0.96 HSP90AA1 (0.39) HSP90AA1CCR2HSP90AB1PDK1CCR3
SCHEMBL22548219 0.96 CCR2 (0.40) HSP90AA1CCR2HSP90AB1PDK1BRD4
SCHEMBL22548269 0.91 CCR3 (0.39) HSP90AA1HSP90AB1PDK1CCR3HSP90B1
SCHEMBL22547832 0.85 CCR3 (0.39) HSP90AA1HSP90AB1BRD4CCR3
SCHEMBL22541300 0.84 HSP90AA1 (0.40) HSP90AA1HSP90AB1PDK1BRD4HSP90B1
SCHEMBL22541296 0.83 MEN1 (0.43) HSP90AA1HSP90AB1PDK1BRD4HSP90B1
SCHEMBL16569200 0.82 KDM4E (0.42) HSP90AA1HSP90AB1
SCHEMBL24321350 0.82 MEN1 (0.47) HSP90AA1HSP90AB1PDK1HSP90B1TRAP1
SCHEMBL24321700 0.82 HSP90AA1 (0.44) HSP90AA1HSP90AB1HSP90B1TRAP1
SCHEMBL18561685 0.82 HSP90AA1 (0.40) HSP90AA1HSP90AB1PDK1BRD4HSP90B1

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
WO-2020207396-A1 METHODS AND COMPOSITIONS FOR TARGETED PROTEIN DEGRADATION RANOK THERAPEUTICS (HANGZHOU) CO. LTD. (CN) 2020-10-15 — — WO disclosed
WO-2020207395-A1 METHODS AND COMPOSITIONS FOR TARGETED PROTEIN DEGRADATION RANOK THERAPEUTICS (HANGZHOU) CO., LTD. (CN) 2020-10-15 — — WO disclosed
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