SCHEMBL440188

SCHEMBL440188

NSc1cc[c]cc1

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
SCHEMBL2107556 0.73 MAPT (0.44)
SCHEMBL1712836 0.73 NR1H2 (0.40)
SCHEMBL8985697 0.71
SCHEMBL1149898 0.69
SCHEMBL6926292 0.69
SCHEMBL19561417 0.69 CYP3A4 (0.30)
SCHEMBL76856 0.69
SCHEMBL10534201 0.69
SCHEMBL1359543 0.69
SCHEMBL714545 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 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0092037-A1 Glucopyranosyl sulfates as modulators of the complement system AMERICAN CYANAMID COMPANY (US) 1983-10-26 EP claimed
EP-2793900-B1 ALPHA-AMINO BORONIC ACID DERIVATIVES, SELECTIVE IMMUNOPROTEASOME INHIBITORS ARES TRADING SA (CH) 2018-08-22 EP disclosed
US-9688702-B2 Alpha-amino boronic acid derivatives, selective immunoproteasome inhibitors ARES TRADING (CH) 2017-06-27 US disclosed
US-9150519-B2 6-amino-pyrimidine-4-carboxamide derivatives and related compounds which bind to the sphingosine 1-phosphate (S1P) receptor for the treatment of multiple sclerosis MERCK SERONO SA (CH) 2015-10-06 US disclosed
US-20150274657-A1 PYRROLIDINES MERCK PATENT GMBH (DE) 2015-10-01 US disclosed
EP-2903966-A1 PYRROLIDINES Merck Patent GmbH (DE) 2015-08-12 EP disclosed
US-20140364396-A1 Alpha-amino boronic acid derivatives, selective immunoproteasome inhibitors ARES TRADING SA (CH) 2014-12-11 US disclosed
US-8889668-B2 Oxadiazole diaryl compounds MERCK SERONO SA (CH) 2014-11-18 US disclosed
US-8815919-B2 Oxadiazole derivatives MERCK SERONO SA (CH) 2014-08-26 US disclosed
US-8802704-B2 Oxadiazole derivatives MERCK SERONO SA (CH) 2014-08-12 US disclosed
US-5013831-A Medical diagnosis, therapy ENZO BIOCHEM, INC. (US) 1991-05-07 US disclosed
US-5002885-A Detectable molecules, method preparation and use ENZO BIOCHEM, INC. (US) 1991-03-26 US disclosed
US-4952685-A CARRYING A METAL COMPLEXING OR BIOTIN DETECTABLE GROUPS; NUCLEOTIDES ENZO BIOCHEM, INC. (US) 1990-08-28 US disclosed
US-4943523-A METAL CHELATING GROUPS OR BIOTIN ATTACHED TO POLYSACCHARIDES, POLYPEPTIDES, POLYNUCLEOTIDES OR SYNTHETIC POLYMERS; IMMUNOASSAY IMAGING ENZO BIOCHEM, INC. (US) 1990-07-24 US disclosed
US-4849208-A Detectable molecules, method of preparation and use ENZO BIOCHEM, INC. (US) 1989-07-18 US disclosed
US-4849505-A Detectable molecules, method of preparation and use ENZO BIOCHEM, INC. (US) 1989-07-18 US disclosed
US-4843122-A COUPLING AGENT BETWEEN BIOPOLYMER AND CHELATE AGENT OR BIOTIN ENZO BIOCHEM, INC. (US) 1989-06-27 US disclosed
EP-0098252-B1 NEW AND NOVEL GLYCOSIDES, GLYCOCONJUGATES AND PROCESSES FOR THEIR PREPARATION BIOCARB AB (SE) 1989-06-07 EP disclosed
US-4707440-A BIOPOLYMER LINKED TO A CHELATING AGENT BASED ON AN O-CYCLOHEXADIAMINEDIACETIC ACID ENZO BIOCHEM, INC. (US) 1987-11-17 US disclosed
EP-0154788-A2 Detectable molecules, method of preparation and use ENZO BIOCHEM, INC. (US) 1985-09-18 EP disclosed