SCHEMBL31298675

SCHEMBL31298675

CC(C)(C)OC(=O)NCCCCC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)N[C@@H](CCCCNC(=O)CCCc1ccc(I)cc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ALB P02768 7/20 0.47
▸ TLR2 O60603 2/20 0.43
▸ MDM2 Q00987 2/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ GLP1R P43220 6/20 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
SCHEMBL20530037 1.00 ALB (0.47) ALBTLR2MDM2CA9GLP1R
SCHEMBL31298693 0.98 ALB (0.48) ALBTLR2CA9GLP1R
SCHEMBL29521884 0.96 TLR2 (0.41) ALBTLR2MDM2
SCHEMBL21963477 0.93 MDM2 (0.42) ALBTLR2MDM2
SCHEMBL21963478 0.93 MDM2 (0.42) ALBTLR2MDM2
SCHEMBL30895538 0.92 TLR2 (0.49) TLR2MDM2GLP1R
SCHEMBL30895452 0.92 TLR2 (0.48) TLR2MDM2GLP1R
SCHEMBL20530026 0.90 ALB (0.53) ALBTLR2MDM2CA9
SCHEMBL31298671 0.90 ALB (0.48) ALBTLR2MDM2CA9GLP1R
SCHEMBL29521888 0.90 ALB (0.44) ALBTLR2MDM2CA9

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-2025029608-A1 FIBROBLAST ACTIVATION PROTEIN-TARGETED COMPOSITIONS AND METHODS OF USE THEREOF RATIO THERAPEUTICS, INC. (US) 2025-02-06 — — WO disclosed
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