SCHEMBL4293232

SCHEMBL4293232

O=C(O)CCCS.[NaH]

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
SCHEMBL37529 0.97
SCHEMBL11145645 0.94 FOLH1 (0.78)
Hydrochloric Acid SCHEMBL9687184 0.94
Hydrochloric Acid SCHEMBL7707629 0.94
SCHEMBL10948013 0.91 FOLH1 (0.94)
Thioglycolic Acid SCHEMBL561884 0.91 FOLH1 (0.74)
SCHEMBL18582542 0.88 FOLH1 (0.89)
SCHEMBL18582712 0.88 FOLH1 (0.89)
Ethylene Glycol SCHEMBL3093527 0.88 FOLH1 (0.70)
SCHEMBL18582081 0.88 FOLH1 (0.89)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8344115-B2 Immunoassay for specific determination of S-adenosylmethionine and analogs thereof in biological samples HAO, XIUJUAN 2013-01-01 US disclosed
WO-2009131643-A1 IMMUNOASSAY FOR SPECIFIC DETERMINATION OF S-ADENOSYMETHIONINE AND ANALOGS THEREOF IN BIOLOGICAL SAMPLES MONABIO, INC. (US) 2009-10-29 WO disclosed
US-20090263879-A1 Immunoassay for specific determination of S-adenosylmethionine and analogs thereof in biological samples HAO, XIUJUAN 2009-10-22 US disclosed