SCHEMBL4404840

SCHEMBL4404840

CC(=O)SCN

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
SCHEMBL5597124 0.75
Bromide SCHEMBL27092037 0.73
Hydrochloric Acid SCHEMBL5967571 0.73
SCHEMBL22551299 0.72 CYP2C19 (0.60)
SCHEMBL6444227 0.72
SCHEMBL9129718 0.71
SCHEMBL10583845 0.69
SCHEMBL10403366 0.69
SCHEMBL10403365 0.69
SCHEMBL15791167 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115745857-A Orally-administered active oxygen-responsive thioester compound, and synthesis method and application thereof 中国医学科学院放射医学研究所 2023-03-07 CN disclosed
US-8822442-B2 Somatostatin-dopamine chimeric analogs IPSEN PHARMA S.A.S. (FR) 2014-09-02 US disclosed
US-8324386-B2 Somatostatin-dopamine chimeric analogs IPSEN PHARMA S.A.S. (FR) 2012-12-04 US disclosed
US-8178651-B2 Somatostatin-dopamine chimeric analogs IPSEN PHARMA, S.A.S. (FR) 2012-05-15 US disclosed
US-20100179304-A1 Somatostatin-Dopamine Chimeric analogs IPSEN PHARMA S.A.S. (FR) 2010-07-15 US disclosed
US-20090275501-A1 Somatostatin-dopamine chimeric analogs IPSEN PHARMA S.A.S. (FR) 2009-11-05 US disclosed
US-7579435-B2 Somatostatin-dopamine chimeric analogs SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES, S.A.S. (FR) 2009-08-25 US disclosed
US-7572883-B2 Somatostatin-dopamine chimeric analogs SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES, S.A.S. (FR) 2009-08-11 US disclosed
EP-0716693-A1 METHOD AND REAGENT FOR INHIBITING HUMAN IMMUNODEFICIENCY VIRUS REPLICATION RIBOZYME PHARMACEUTICALS, INC. (US) 1996-06-19 EP disclosed
WO-1995004818-A1 METHOD AND REAGENT FOR INHIBITING HUMAN IMMUNODEFICIENCY VIRUS REPLICATION RIBOZYME PHARMACEUTICALS, INC. (US) 1995-02-16 WO disclosed