SCHEMBL31298693

SCHEMBL31298693

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

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ALB P02768 7/20 0.48
▸ CA9 Q16790 1/20 0.42
▸ GLP1R P43220 8/20 0.42
▸ TLR2 O60603 2/20 0.41
▸ TLR1 Q15399 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
SCHEMBL20530037 0.98 ALB (0.47) ALBCA9GLP1RTLR2
SCHEMBL31298675 0.98 ALB (0.47) ALBCA9GLP1RTLR2
SCHEMBL29521884 0.94 TLR2 (0.41) ALBTLR2TLR1
SCHEMBL20530026 0.92 ALB (0.53) ALBCA9TLR2
SCHEMBL31298671 0.92 ALB (0.48) ALBCA9GLP1RTLR2
SCHEMBL29521888 0.92 ALB (0.44) ALBCA9TLR2TLR1
SCHEMBL21963478 0.91 MDM2 (0.42) ALBTLR2TLR1
SCHEMBL21963477 0.91 MDM2 (0.42) ALBTLR2TLR1
SCHEMBL30895538 0.90 TLR2 (0.49) GLP1RTLR2TLR1
SCHEMBL30895452 0.90 TLR2 (0.48) GLP1RTLR2TLR1

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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