SCHEMBL7962608

SCHEMBL7962608

CCCC(C)SC

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
SCHEMBL21251184 0.83 TSHR (0.42)
SCHEMBL7952336 0.81
SCHEMBL20756409 0.79 TSHR (0.33)
SCHEMBL21554643 0.77 OPRM1 (0.46)
SCHEMBL12843895 0.77 OPRM1 (0.46)
SCHEMBL12424290 0.77 OPRM1 (0.46)
SCHEMBL7141137 0.77 OPRM1 (0.46)
SCHEMBL23236833 0.76 TSHR (0.38)
SCHEMBL777162 0.76 TSHR (0.38)
SCHEMBL16710738 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180221499-A1 SSTR-TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF TVA (ABC), LLC 2018-08-09 US disclosed
US-20180000959-A1 TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF TVA (ABC), LLC 2018-01-04 US disclosed
CN-105237473-B The 4,5,6 multifunctional amino nicotinic acid nitrile derivatives of dough 2 and preparation method 浙江大学 2017-12-26 CN disclosed
US-20170312245-A1 TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF TVA (ABC), LLC 2017-11-02 US disclosed
US-9750818-B2 Targeted conjugates and particles and formulations thereof TARVEDA THERAPEUTICS, INC. (US) 2017-09-05 US disclosed
US-20170095569-A1 TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF TVA (ABC), LLC 2017-04-06 US disclosed
US-20160333277-A1 METHOD FOR REMOVING SULFUR COMPOUNDS FROM HYDROCARBON STREAMS BASF SE (DE) 2016-11-17 US disclosed
EP-3092288-A1 METHOD FOR REMOVING SULFUR COMPOUNDS FROM HYDROCARBON STREAMS BASF SE (DE) 2016-11-16 EP disclosed
US-20160058882-A1 CYTOTOXIC AGENTS COMPRISING NEW ANSAMITOCIN DERIVATIVES IMMUNOGEN, INC. 2016-03-03 US disclosed
US-9090629-B2 Cytotoxic agents comprising new ansamitocin derivatives IMMUNOGEN, INC. (US) 2015-07-28 US disclosed
US-5817603-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1998-10-06 US disclosed
WO-1998022486-A1 HETEROCYCLIC METALLOCENES AND POLYMERIZATION CATALYSTS MONTELL TECHNOLOGY COMPANY B.V. (NL) 1998-05-28 WO disclosed
EP-0777658-A1 SUBSTITUTED TRIAZOLINONES AS PLANT PROTECTIVE AGENTS BASF AKTIENGESELLSCHAFT (DE) 1997-06-11 EP disclosed
US-5602074-A HERBICIDES; PLANT DESICCATION, DEFOLIATION BASF AKTIENGESELLSCHAFT (DE) 1997-02-11 US disclosed
WO-1996005179-A1 SUBSTITUTED TRIAZOLINONES AS PLANT PROTECTIVE AGENTS BASF AKTIENGESELLSCHAFT (DE) 1996-02-22 WO disclosed
EP-0641321-A1 SUBSTITUTED ISOINDOLONES BASF Aktiengesellschaft (DE) 1995-03-08 EP disclosed
EP-0637298-A1 SUBSTITUTED CYCLOHEXENE-1,2-BICARBOXYLIC ACID DERIVATIVES AND RAW MATERIALS FOR PRODUCING THEM BASF Aktiengesellschaft (DE) 1995-02-08 EP disclosed
WO-1994011344-A1 SUBSTITUTED 3,4,5,6-TETRAHYDROPHTHALIMIDES FOR USE AS HERBICIDES AND/OR DEFOLIANTS OR DESICCANTS BASF AKTIENGESELLSCHAFT (DE) 1994-05-26 WO disclosed
WO-1993024456-A1 SUBSTITUTED ISOINDOLONES BASF AKTIENGESELLSCHAFT (DE) 1993-12-09 WO disclosed
WO-1993022280-A1 SUBSTITUTED CYCLOHEXENE-1,2-BICARBOXYLIC ACID DERIVATIVES AND RAW MATERIALS FOR PRODUCING THEM BASF AKTIENGESELLSCHAFT (DE) 1993-11-11 WO disclosed