SCHEMBL2539746

SCHEMBL2539746

[CH2]CCCC(C)C#N

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
SCHEMBL2536202 0.92
SCHEMBL2537735 0.90 TSHR (0.46)
SCHEMBL388090 0.83
SCHEMBL3628455 0.83 TSHR (0.60)
SCHEMBL3629254 0.83 TSHR (0.60)
SCHEMBL28992501 0.80 TSHR (0.57)
SCHEMBL3630677 0.80 TSHR (0.57)
SCHEMBL29273359 0.80 TSHR (0.57)
SCHEMBL10932800 0.76 TSHR (0.67)
SCHEMBL16501370 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1934278-B1 NON-STAINING ANTIDEGRADANTS FOR VULCANIZED ELASTOMERS BASF SE (DE) 2013-12-11 EP disclosed
US-8044070-B2 Heteroaryloxy nitrogenous saturated heterocyclic derivative MSD K.K. (JP) 2011-10-25 US disclosed
US-7799951-B2 Non-staining antidegradants for vulcanized elastomers CIBA CORPORATION (US) 2010-09-21 US disclosed
US-7790897-B2 Graftable hindered amine light stabilizers CIBA SPECIALTY CHEMICALS CORP. (US) 2010-09-07 US disclosed
US-20100210637-A1 HETEROARYLOXY NITROGENOUS SATURATED HETEROCYCLIC DERIVATIVE MSD K.K. (JP) 2010-08-19 US disclosed
US-7595316-B2 Heteroaryloxy nitrogenous saturated heterocyclic derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-09-29 US disclosed
US-20090227730-A1 Non-Staining Antidegradants for Vulcanized Elastomers CIBA CORPORATION (US) 2009-09-10 US disclosed
US-20090144915-A1 Graftable hindered amine light stabilizers MEIER HANS-RUDOLF 2009-06-11 US disclosed
US-7504510-B2 Graftable hindered amine light stabilizers CIBA SPECIALTY CHEMICALS CORP. (US) 2009-03-17 US disclosed
EP-1934278-A2 NON-STAINING ANTIDEGRADANTS FOR VULCANIZED ELASTOMERS Ciba Holding Inc. (CH) 2008-06-25 EP disclosed
US-5707937-A AGRICULTURAL HERBICIDES, DESICCANTS, DEFOLIANTS, HARVESTING AIDS BASF AKTIENGESELLSCHAFT (DE) 1998-01-13 US disclosed
EP-0777658-A1 SUBSTITUTED TRIAZOLINONES AS PLANT PROTECTIVE AGENTS BASF AKTIENGESELLSCHAFT (DE) 1997-06-11 EP disclosed
WO-1997008171-A1 SUBSTITUTED BENZOTHIAZOLS WITH HERBICIDAL ACTION BASF AKTIENGESELLSCHAFT (DE) 1997-03-06 WO disclosed
EP-0460883-B1 Process for beta-hydroxy-alpha-amino acids UNIV NOTRE DAME DU LAC (US) 1997-01-15 EP disclosed
WO-1996014298-A1 SUBSTITUTED PHTHALIMIDO-CINNAMIC ACID DERIVATIVES WITH HERBICIDAL EFFECT BASF AKTIENGESELLSCHAFT (DE) 1996-05-17 WO disclosed
WO-1996005179-A1 SUBSTITUTED TRIAZOLINONES AS PLANT PROTECTIVE AGENTS BASF AKTIENGESELLSCHAFT (DE) 1996-02-22 WO disclosed
EP-0628638-A2 Process for preparing 2-amino-3-hydroxy acids ELI LILLY AND COMPANY (US) 1994-12-14 EP disclosed
US-5266468-A Process for preparing β-hydroxy-α amino acids UNIVERSITY OF NOTRE DAME DU LAC (US) 1993-11-30 US disclosed
EP-0460883-A2 Process for beta-hydroxy-alpha-amino acids THE UNIVERSITY OF NOTRE DAME DU LAC (US) 1991-12-11 EP disclosed
EP-0266890-A1 Imidazopyridine derivatives, their production, and pharmaceutical compositions containing them YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1988-05-11 EP disclosed