SCHEMBL23859976

SCHEMBL23859976

NC(=O)CCC(NC(=O)[C@@H]1CC[C@@H]2CCN(C(=O)CCCCCC#Cc3cccc4c3CN(C3CCC(=O)NC3=O)C4=O)C[C@H](NC(=O)c3cc4cc(C(F)(F)P(=O)(O)O)ccc4s3)C(=O)N21)c1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 10/20 0.76
▸ STAT1 P42224 1/20 0.76
▸ STAT4 Q14765 1/20 0.76
▸ STAT5A P42229 2/20 0.53
▸ STAT5B P51692 2/20 0.53
▸ CRBN Q96SW2 3/20 0.52
▸ KDM5A P29375 1/20 0.52
▸ KDM5B Q9UGL1 1/20 0.52
▸ XIAP P98170 4/20 0.37
▸ BIRC3 Q13489 4/20 0.37
▸ BIRC2 Q13490 4/20 0.37
▸ GSK3B P49841 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 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
SCHEMBL23859973 1.00 STAT3 (0.76) STAT3STAT1STAT4STAT5ASTAT5B
SCHEMBL22468634 0.95 STAT3 (0.85) STAT3STAT1STAT4STAT5ASTAT5B
SCHEMBL22468630 0.95 STAT3 (0.85) STAT3STAT1STAT4STAT5ASTAT5B
SCHEMBL25265783 0.94 STAT3 (0.78) STAT3STAT1STAT4STAT5ASTAT5B
SCHEMBL25265784 0.94 STAT3 (0.78) STAT3STAT1STAT4STAT5ASTAT5B
SCHEMBL25197555 0.94 STAT3 (0.78) STAT3STAT1STAT4STAT5ASTAT5B
SCHEMBL30308495 0.94 STAT3 (0.78) STAT3STAT1STAT4STAT5ASTAT5B
SCHEMBL23860008 0.94 STAT3 (0.76) STAT3STAT1STAT4STAT5ASTAT5B
SCHEMBL23860002 0.94 STAT3 (0.76) STAT3STAT1STAT4STAT5ASTAT5B
SCHEMBL23860006 0.94 STAT3 (0.76) STAT3STAT1STAT4STAT5ASTAT5B

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-2021195481-A1 SMALL MOLECULE STAT PROTEIN DEGRADERS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2021-09-30 — — WO disclosed
Send feedback