SCHEMBL31033030

SCHEMBL31033030

C=CC(=O)NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2cccc3ccccc23)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 20/20 1.00

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
SCHEMBL19480306 1.00 TGM2 (1.00) TGM2
SCHEMBL22895154 0.88 TGM2 (1.00) TGM2
SCHEMBL29988576 0.88 TGM2 (0.79) TGM2
SCHEMBL29988587 0.88 TGM2 (1.00) TGM2
SCHEMBL22895106 0.87 TGM2 (1.00) TGM2
SCHEMBL31032974 0.87 TGM2 (1.00) TGM2
SCHEMBL29988586 0.87 TGM2 (1.00) TGM2
SCHEMBL29988979 0.86 TGM2 (1.00) TGM2
SCHEMBL31239720 0.86 TGM2 (1.00) TGM2
SCHEMBL19480311 0.86 TGM2 (1.00) TGM2

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
EP-3442533-B1 TG2 INHIBITOR COMPOUNDS AND USES THEREOF UNIV OTTAWA (CA) 2024-08-07 — — EP disclosed
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