SCHEMBL25811623

SCHEMBL25811623

CCS(=O)(=O)Nc1ccc(-c2nn(C)c3c(-c4cnn(CCOCCOCC(=O)N[C@H](C(=O)N5CCC[C@H]5C(=O)NCc5ccc(-c6scnc6C)cc5)C(C)(C)C)c4)cnc(N)c23)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
VHL P40337 8/20 0.50
ELOC Q15369 3/20 0.50
ELOB Q15370 3/20 0.50
STAT3 P40763 1/20 0.45
SGK1 O00141 2/20 0.45
RPS6KB1 P23443 2/20 0.45
SGK3 Q96BR1 2/20 0.45
BRD9 Q9H8M2 1/20 0.43
IRAK3 Q9Y616 3/20 0.43
HDAC3 O15379 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
RIPK2 O43353 3/20 0.42
CRBN Q96SW2 1/20 0.42
ABL1 P00519 1/20 0.42
BCR P11274 1/20 0.42
NAMPT P43490 4/20 0.41
GRAMD1A Q96CP6 1/20 0.41

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 0.92 VHL (0.62) VHLELOCELOBSTAT3SGK1
SCHEMBL30566196 0.92 VHL (0.62) VHLELOCELOBSTAT3SGK1
SCHEMBL25250375 0.92 VHL (0.62) VHLELOCELOBSTAT3SGK1
SCHEMBL25291952 0.83 VHL (0.55) VHLELOCELOBHDAC3HDAC1
SCHEMBL30566234 0.83 VHL (0.55) VHLELOCELOBHDAC3HDAC1
SCHEMBL25251496 0.83 VHL (0.55) VHLELOCELOBHDAC3HDAC1
SCHEMBL25821438 0.82 VHL (0.41) VHLELOCELOBSTAT3SGK1
SCHEMBL31461760 0.81 VHL (0.61) VHLELOCELOBSTAT3SGK1
SCHEMBL25298538 0.81 VHL (0.39) VHLELOCELOBSTAT3SGK1
SCHEMBL25856310 0.78 VHL (0.78) VHLELOCELOBSTAT3ABL1

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