SCHEMBL7441395

SCHEMBL7441395

COC(=O)[C@@H](CCN(C1CCCCC1)C1CCCCC1)N(CC(=O)O)C(=O)[C@H](C)CS

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL7436467 0.89
SCHEMBL7435846 0.89
SCHEMBL7428270 0.82 SMN1; SMN2 (0.37)
SCHEMBL7428279 0.82 SMN1; SMN2 (0.37)
SCHEMBL7441389 0.80
SCHEMBL7441399 0.80
SCHEMBL7429805 0.75
SCHEMBL7431710 0.75
SCHEMBL7429809 0.75
SCHEMBL7431715 0.75

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-0384636-A1 Pharmaceutically active compounds FISONS plc (GB) 1990-08-29 EP claimed
EP-0384636-A1 Pharmaceutically active compounds FISONS plc (GB) 1990-08-29 EP disclosed