SCHEMBL30329419

SCHEMBL30329419

NC(=O)Cc1ccc(CN(CC(=O)O)C2CCCCC2N(CC(=O)O)CC(=O)O)cc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 1/20 0.40
▸ RORC P51449 1/20 0.36
▸ SLC18A3 Q16572 1/20 0.35
▸ SIGMAR1 Q99720 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ CTSD P07339 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33
▸ EPHX2 P34913 1/20 0.33

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
SCHEMBL22593578 0.90 CA2 (0.41) CA2SLC18A3SIGMAR1MEN1ALDH1A1
SCHEMBL22815239 0.86 SLC18A3 (0.38) SLC18A3SIGMAR1MEN1ALDH1A1KMT2A
SCHEMBL27398620 0.86 SLC18A3 (0.38) SLC18A3SIGMAR1MEN1ALDH1A1KMT2A
SCHEMBL29761165 0.84 SLC18A3 (0.49) SLC18A3SIGMAR1MEN1ALDH1A1KMT2A
SCHEMBL20506803 0.84 SLC18A3 (0.49) SLC18A3SIGMAR1MEN1ALDH1A1KMT2A
SCHEMBL20506805 0.84 SLC18A3 (0.49) SLC18A3SIGMAR1MEN1ALDH1A1KMT2A
SCHEMBL23085113 0.83 SLC18A3 (0.35) SLC18A3SIGMAR1MEN1ALDH1A1KMT2A
SCHEMBL25162267 0.83 SLC18A3 (0.35) SLC18A3SIGMAR1MEN1ALDH1A1KMT2A
SCHEMBL27398776 0.83 SLC18A3 (0.35) SLC18A3SIGMAR1MEN1ALDH1A1KMT2A
SCHEMBL25703421 0.82 SIGMAR1 (0.37) SLC18A3SIGMAR1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4412996-A1 RADIOLABELLED FIBROBLAST ACTIVATION PROTEIN LIGANDS Philochem AG (CH) 2024-08-14 — — EP claimed
WO-2023057457-A1 RADIOLABELLED FIBROBLAST ACTIVATION PROTEIN LIGANDS PHILOCHEM AG (CH) 2023-04-13 — — WO claimed
EP-4412996-A1 RADIOLABELLED FIBROBLAST ACTIVATION PROTEIN LIGANDS Philochem AG (CH) 2024-08-14 — — EP disclosed
WO-2023057457-A1 RADIOLABELLED FIBROBLAST ACTIVATION PROTEIN LIGANDS PHILOCHEM AG (CH) 2023-04-13 — — WO disclosed
Send feedback