SCHEMBL25250375

SCHEMBL25250375

CCS(=O)(=O)Nc1ccc(-c2nn(C)c3c(-c4cnn(CCOCCOCC(=O)N[C@H](C(=O)N5C[C@H](O)C[C@H]5C(=O)NCc5ccc(-c6scnc6C)cc5)C(C)(C)C)c4)cnc(N)c23)cc1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
VHL P40337 15/20 0.62
ELOC Q15369 3/20 0.62
ELOB Q15370 3/20 0.62
STAT3 P40763 1/20 0.55
BRD9 Q9H8M2 1/20 0.51
RIPK2 O43353 3/20 0.51
ABL1 P00519 1/20 0.51
BCR P11274 1/20 0.51
HDAC3 O15379 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC2 Q92769 1/20 0.51
CRBN Q96SW2 1/20 0.51
SGK1 O00141 2/20 0.51
RPS6KB1 P23443 2/20 0.51
SGK3 Q96BR1 2/20 0.51
HDAC4 P56524 2/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC9 Q9UKV0 1/20 0.50
HDAC5 Q9UQL6 1/20 0.50

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
SCHEMBL25298140 1.00 VHL (0.62) VHLELOCELOBSTAT3BRD9
SCHEMBL30566196 1.00 VHL (0.62) VHLELOCELOBSTAT3BRD9
SCHEMBL25811623 0.92 VHL (0.50) VHLELOCELOBSTAT3BRD9
SCHEMBL30566234 0.91 VHL (0.55) VHLELOCELOBHDAC3HDAC1
SCHEMBL25251496 0.91 VHL (0.55) VHLELOCELOBHDAC3HDAC1
SCHEMBL25291952 0.91 VHL (0.55) VHLELOCELOBHDAC3HDAC1
SCHEMBL31461760 0.89 VHL (0.61) VHLELOCELOBSTAT3BRD9
SCHEMBL30566169 0.86 VHL (0.54) VHLELOCELOBHDAC3HDAC1
SCHEMBL25291348 0.86 VHL (0.54) VHLELOCELOBHDAC3HDAC1
SCHEMBL25248631 0.86 VHL (0.54) VHLELOCELOBHDAC3HDAC1

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-2023115150-A1 BIFUNCTIONAL ARYLSULPHONAMIDE COMPOUNDS Anaxis Pharma Pty Ltd (AU) 2023-06-29 WO disclosed