SCHEMBL9199173

SCHEMBL9199173

O=C(O)OC1=NCCS1

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
SCHEMBL28109604 0.98 SMN1; SMN2 (0.34)
Di(Hydroxyethyl)Ether SCHEMBL28085088 0.86 TSHR (0.32)
SCHEMBL27445735 0.84 LMNA (0.36)
SCHEMBL27333836 0.81 LMNA (0.34)
SCHEMBL28148120 0.81 LMNA (0.34)
SCHEMBL27678339 0.81
SCHEMBL27263283 0.81
SCHEMBL27692796 0.79 MAPT (0.35)
SCHEMBL27259920 0.79 HPGD (0.37)
SCHEMBL27482160 0.79 LMNA (0.37)

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
CN-1263924-C Lotioned fibrous web SCA HYGIENE PROD GMBH (DE) 2006-07-12 CN disclosed
CN-1478166-A Lotioned fibrous web SCA������Ʒ���޹�˾ 2004-02-25 CN disclosed
EP-0513543-B1 Derivatives of amidinophenylalanine, procedure for their preparation, their utilisation and anticoagulant compositions comprising them. BEHRINGWERKE AG (DE) 1995-10-25 EP disclosed
EP-0513543-A1 Derivatives of amidinophenylalanine, procedure for their preparation, their utilisation and anticoagulant compositions comprising them. BEHRINGWERKE Aktiengesellschaft (DE) 1992-11-19 EP disclosed