SCHEMBL29988979

SCHEMBL29988979

C=CC(=O)NCCCCC(NC(=O)c1cccc2ccccc12)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
SCHEMBL31239720 1.00 TGM2 (1.00) TGM2
SCHEMBL29988586 0.95 TGM2 (1.00) TGM2
SCHEMBL29989167 0.94 TGM2 (1.00) TGM2
SCHEMBL29988967 0.92 TGM2 (1.00) TGM2
SCHEMBL29988824 0.91 TGM2 (1.00) TGM2
SCHEMBL29988093 0.91 TGM2 (1.00) TGM2
SCHEMBL31239789 0.91 TGM2 (1.00) TGM2
SCHEMBL29989149 0.91 TGM2 (1.00) TGM2
SCHEMBL31239702 0.90 TGM2 (1.00) TGM2
SCHEMBL29988571 0.90 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4320106-A1 ARYLACETYL INHIBITORS OF TG2 AND USES THEREOF University Of Ottawa (CA) 2024-02-14 — — EP disclosed
WO-2022213198-A1 ARYLACETYL INHIBITORS OF TG2 AND USES THEREOF UNIVERSITY OF OTTAWA (CA) 2022-10-13 — — WO disclosed
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