SCHEMBL44469

SCHEMBL44469

CC(C)(C#N)CCCCOc1[c]cc[c]c1

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
SCHEMBL3965745 0.98
SCHEMBL3757534 0.75 NR5A1 (0.38)
SCHEMBL4624291 0.74 LTA4H (0.33)
SCHEMBL5453657 0.72
SCHEMBL7146702 0.71 USP8 (0.30)
SCHEMBL8535485 0.69 ALDH1A1 (0.34)
SCHEMBL1177660 0.68
SCHEMBL9478548 0.66
SCHEMBL7168783 0.64
SCHEMBL7261743 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015050869-A1 POLYMERSOME ENCAPSULATION OF HYDROPHOBIC FLUORESCENT POLYMERS BECTON DICKINSON AND COMPANY (US) 2015-04-09 WO disclosed
EP-2723721-A1 POLYPHENYLENE HOST COMPOUNDS Nitto Denko Corporation (JP) 2014-04-30 EP disclosed
EP-2668247-A1 PHOTOTHERAPY DEVICES AND METHODS COMPRISING OPTIONALLY SUBSTITUTED TERPHENYL AND QUATERPHENYL COMPOUNDS Nitto Denko Corporation (JP) 2013-12-04 EP disclosed
EP-2655338-A1 BENZOIMIDAZOLE DERIVATIVES FOR USE IN LIGHT - EMITTING DEVICES Nitto Denko Corporation (JP) 2013-10-30 EP disclosed
EP-2638578-A1 HYBRID COMPOSITE EMISSIVE CONSTRUCT AND LIGHT-EMITTING DEVICES USING THE SAME Nitto Denko Corporation (JP) 2013-09-18 EP disclosed
EP-2616457-A1 SUBSTITUTED BIPYRIDINES FOR USE IN ORGANIC LIGHT-EMITTING DEVICES Nitto Denko Corporation (JP) 2013-07-24 EP disclosed
WO-2013039914-A1 EFFICIENT ORGANIC LIGHT-EMITTING DIODES AND FABRICATION OF THE SAME NITTO DENKO CORPORATION (JP) 2013-03-21 WO disclosed
WO-2012177914-A1 POLYPHENYLENE HOST COMPOUNDS NITTO DENKO CORPORATION (JP) 2012-12-27 WO disclosed
WO-2012119111-A1 POROUS FILMS FOR USE IN LIGHT-EMITTING DEVICES NITTO DENKO CORPORATION (JP) 2012-09-07 WO disclosed
WO-2012103380-A1 PHOTOTHERAPY DEVICES AND METHODS COMPRISING OPTIONALLY SUBSTITUTED TERPHENYL AND QUATERPHENYL COMPOUNDS NITTO DENKO CORPORATION (JP) 2012-08-02 WO disclosed
WO-2012064987-A1 HYBRID COMPOSITE EMISSIVE CONSTRUCT AND LIGHT-EMITTING DEVICES USING THE SAME NITTO DENKO CORPORATION (JP) 2012-05-18 WO disclosed
EP-2448925-A1 EMISSIVE ARYL-HETEROARYL COMPOUNDS Nitto Denko Corporation (JP) 2012-05-09 EP disclosed
WO-2012037269-A1 SUBSTITUTED BIPYRIDINES FOR USE IN ORGANIC LIGHT-EMITTING DEVICES NITTO DENKO CORPORATION (JP) 2012-03-22 WO disclosed
WO-2012009283-A1 PHOTOTHERAPY METHODS AND DEVICES COMPRISING EMISSIVE ARYL-HETEROARYL COMPOUNDS NITTO DENKO CORPORATION (JP) 2012-01-19 WO disclosed
WO-2011149500-A1 EMISSIVE COMPOUNDS FOR ORGANIC LIGHT-EMITTING DIODES NITTO DENKO CORPORATION (JP) 2011-12-01 WO disclosed
WO-2011097260-A1 TRIS (ARYLBENZOXAZOLE) BENZENE AND TRIS (ARYLBENZOTHIAZOLE) BENZENE AS ORGANIC ELECTRON - TRANS PORT MATERIALS NITTO DENKO CORPORATION (JP) 2011-08-11 WO disclosed
WO-2011097259-A1 ORGANIC LIGHT-EMITTING DIODE WITH ENHANCED EFFICIENCY NITTO DENKO CORPORATION (JP) 2011-08-11 WO disclosed
WO-2011034967-A1 COMPOUNDS FOR ORGANIC LIGHT EMITTING DIODE EMISSIVE LAYERS NITTO DENKO CORPORATION (JP) 2011-03-24 WO disclosed
WO-2011008560-A1 EMISSIVE ARYL-HETEROARYL COMPOUNDS NITTO DENKO CORPORATION (JP) 2011-01-20 WO disclosed
WO-2010141758-A1 EMISSIVE ARYL-HETEROARYL ACETYLENES NITTO DENKO CORPORATION (JP) 2010-12-09 WO disclosed