SCHEMBL6123591

SCHEMBL6123591

CC(C)(C)c1nc(O)ns1

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
SCHEMBL803125 0.72 CNR2 (0.31)
SCHEMBL2619434 0.72
SCHEMBL21718712 0.70
SCHEMBL20711402 0.70 LMNA (0.34)
SCHEMBL21720314 0.70
SCHEMBL12245280 0.68 CCNE2 (0.33)
SCHEMBL21304668 0.67
SCHEMBL21720106 0.67 PTGS2 (0.34)
SCHEMBL13079756 0.67
SCHEMBL21366422 0.66 SMN1; SMN2 (0.41)

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10273234-B2 Compounds that are S1P modulating agents and/or ATX modulating agents BIOGEN MA INC. (US) 2019-04-30 US disclosed
US-10017506-B2 ATX modulating agents BIOGEN MA INC. (US) 2018-07-10 US disclosed
US-10017506-B2 ATX modulating agents BIOGEN MA INC. (US) 2018-07-10 US disclosed
US-9944666-B2 Compounds that are S1P modulating agents and/or ATX modulating agents BIOGEN MA INC. (US) 2018-04-17 US disclosed
US-9944666-B2 Compounds that are S1P modulating agents and/or ATX modulating agents BIOGEN MA INC. (US) 2018-04-17 US disclosed
US-9850206-B2 S1P and/or ATX modulating agents BIOGEN MA INC. (US) 2017-12-26 US disclosed
US-9850206-B2 S1P and/or ATX modulating agents BIOGEN MA INC. (US) 2017-12-26 US disclosed
US-9771326-B2 S1P and/or ATX modulating agents BIOGEN MA INC. (US) 2017-09-26 US disclosed
US-9771326-B2 S1P and/or ATX modulating agents BIOGEN MA INC. (US) 2017-09-26 US disclosed
US-9765016-B2 S1P modulating agents BIOGEN MA INC. (US) 2017-09-19 US disclosed
US-20150361029-A1 S1P MODULATING AGENTS BIOGEN MA INC. 2015-12-17 US disclosed
US-20150299123-A1 S1P AND/OR ATX MODULATING AGENTS BIOGEN MA INC. 2015-10-22 US disclosed
US-20150274663-A1 S1P AND/OR ATX MODULATING AGENTS BIOGEN MA INC. 2015-10-01 US disclosed
US-20150210647-A1 ATX MODULATING AGENTS BIOGEN MA, INC. 2015-07-30 US disclosed
US-20150203515-A1 COMPOUNDS THAT ARE S1P MODULATING AGENTS AND/OR ATX MODULATING AGENTS BIOGEN MA, INC. 2015-07-23 US disclosed
US-20150203493-A1 COMPOUNDS THAT ARE S1P MODULATING AGENTS AND/OR ATX MODULATING AGENTS BIOGEN IDEC MA INC. (US) 2015-07-23 US disclosed
US-20150183741-A1 COMPOUNDS THAT ARE S1P MODULATING AGENTS AND/OR ATX MODULATING AGENTS BIOGEN MA INC. 2015-07-02 US disclosed
US-8173680-B2 Cannabinoid receptor modulators 7TM PHARMA A/S (DK) 2012-05-08 US disclosed
US-20100292273-A1 Cannabinoid Receptor Modulators 7TM PHARMA A/S (DK) 2010-11-18 US disclosed
US-3943144-A INSECTICIDE, MITICIDE CIBA-GEIGY CORPORATION (US) 1976-03-09 US disclosed