SCHEMBL7129291

SCHEMBL7129291

[CH2]C(=C)C1CCCCC1

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
SCHEMBL4194176 0.90
SCHEMBL3193277 0.76 CES2 (0.47)
SCHEMBL10956943 0.76 CES2 (0.47)
SCHEMBL3185717 0.76 CES2 (0.47)
SCHEMBL5659312 0.73
SCHEMBL5929221 0.72 CES2 (0.42)
SCHEMBL9797502 0.71
SCHEMBL22639103 0.71 CES2 (0.58)
SCHEMBL4359650 0.71 CES2 (0.43)
SCHEMBL22639108 0.71 CES2 (0.58)

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020230882-A1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, AND USE THEREOF 三井化学株式会社 2020-11-19 WO disclosed
US-6669740-B2 Suitable for use in the inkjet process and in textile sublimation transfer printing BASF AKTIENGESELLSCHAFT (DE) 2003-12-30 US disclosed
US-20030126693-A1 Dye preparations comprising azo dyes BASF AKIENGESELLSCHAFT (DE) 2003-07-10 US disclosed
US-6537331-B1 Containing no acidic groups; alkoxylated phenol dispersant or arylsulfonic acid-formaldehyde dispersant, a carbohydrate, a polyalkylene glycol; ink jet, textile sublimation transfer printing BASF AKTIENGESELLSCHAFT (DE) 2003-03-25 US disclosed
EP-1036115-B1 DYE PREPARATIONS CONTAINING AZO DYES BASF AG (DE) 2002-02-06 EP disclosed
EP-1036115-A1 DYE PREPARATIONS CONTAINING AZO DYES BASF AKTIENGESELLSCHAFT (DE) 2000-09-20 EP disclosed
EP-1005446-A1 N-AROYLPHENYLALANINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2000-06-07 EP disclosed
WO-1999029783-A1 DYE PREPARATIONS CONTAINING AZO DYES BASF AKTIENGESELLSCHAFT (DE) 1999-06-17 WO disclosed
WO-1999010313-A1 N-AROYLPHENYLALANINE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 1999-03-04 WO disclosed
EP-0630354-B1 MOLECULAR SIEVES CONTAINING AZO DYES HOELDERICH WOLFGANG PROF DR (DE) 1996-11-13 EP disclosed
US-5573585-A Molecular sieves containing azo dyes Hoelderich, Wolfgang (DE) 1996-11-12 US disclosed
EP-0630945-B1 Use of reticulated azo dyes in non-linear optics BASF AG (DE) 1996-10-09 EP disclosed
US-5549853-A Linked azo dyes BASF AKTIENGESELLSCHAFT (DE) 1996-08-27 US disclosed
EP-0544153-B1 Textile application of Thiophene azo dyes with a coupling component of the diaminopyridine series BASF AG (DE) 1996-05-22 EP disclosed
EP-0630354-A1 MOLECULAR SIEVES CONTAINING AZO DYES. BASF AG (DE) 1994-12-28 EP disclosed
EP-0630945-A1 Use of reticulated azo dyes in non-linear optics BASF Aktiengesellschaft (DE) 1994-12-28 EP disclosed
US-5330543-A Dyeing or printing textiles; colorfastness BASF AKTIENGESELLSCHAFT (DE) 1994-07-19 US disclosed
WO-1993017965-A1 MOLECULAR SIEVES CONTAINING AZO DYES BASF AKTIENGESELLSCHAFT (DE) 1993-09-16 WO disclosed
EP-0544153-A1 Textile application of Thiophene azo dyes with a coupling component of the diaminopyridine series BASF Aktiengesellschaft (DE) 1993-06-02 EP disclosed
US-4115635-A Process for the production of poly (allyl halide allyl alcohol) polymer BLOUNT DAVID H 1978-09-19 US disclosed