SCHEMBL5429936

SCHEMBL5429936

[CH2]C(C)C([CH2])CC

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
SCHEMBL6728521 0.79
SCHEMBL3893707 0.77
SCHEMBL828954 0.77
SCHEMBL3892557 0.77
SCHEMBL229948 0.74
SCHEMBL27480254 0.74
SCHEMBL3152622 0.72
SCHEMBL11082029 0.72
SCHEMBL1289712 0.72
SCHEMBL27991561 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060155077-A1 Tyre for vehicle wheels and elastomeric composition PIRELLI PNEUMATICI S.P.A. (IT) 2006-07-13 US claimed
EP-1569997-A1 TYRE FOR VEHICLE WHEELS AND ELASTOMERIC COMPOSITION PIRELLI PNEUMATICI S.p.A. (IT) 2005-09-07 EP claimed
WO-2004052983-A1 TYRE FOR VEHICLE WHEELS AND ELASTOMERIC COMPOSITION PIRELLI PNEUMATICI S.P.A. (IT) 2004-06-24 WO claimed
EP-3386473-B1 OLIGOESTER AMMONIUM SALTS AND THEIR USE IN COSMETIC COMPOSITIONS CLARIANT INT LTD (CH) 2022-04-20 EP disclosed
US-20180369099-A1 Oligoester Ammonium Salts And Their Use In Compositions For Conditioning Hair CLARIANT INTERNATIONAL LTD. (CH) 2018-12-27 US disclosed
US-20180360714-A1 Oligoester Ammonium Salts And Their Use In Cosmetic Compositions CLARIANT INTERNATIONAL LTD. (CH) 2018-12-20 US disclosed
US-20180353410-A1 A Shampoo Composition Comprising At Least One Oligoester Ammonium Salt CLARIANT INTERNATIONAL LTD. (CH) 2018-12-13 US disclosed
EP-3386473-A1 OLIGOESTER AMMONIUM SALTS AND THEIR USE IN COSMETIC COMPOSITIONS Clariant International Ltd (CH) 2018-10-17 EP disclosed
EP-3386474-A1 OLIGOESTER AMMONIUM SALTS AND THEIR USE IN COMPOSITIONS FOR CONDITIONING HAIR Clariant International Ltd (CH) 2018-10-17 EP disclosed
EP-3386472-A1 A SHAMPOO COMPOSITION COMPRISING AT LEAST ONE OLIGOESTER AMMONIUM SALT Clariant International Ltd (CH) 2018-10-17 EP disclosed
WO-2017097819-A1 OLIGOESTER AMMONIUM SALTS AND THEIR USE IN COSMETIC COMPOSITIONS CLARIANT INTERNATIONAL LTD (CH) 2017-06-15 WO disclosed
WO-2017097817-A1 A SHAMPOO COMPOSITION COMPRISING AT LEAST ONE OLIGOESTER AMMONIUM SALT CLARIANT INTERNATIONAL LTD (CH) 2017-06-15 WO disclosed
US-20070276062-A1 Process For Producing An Epoxidized Elastomeric Polymer PIRELLI PNEUMATICI S.P.A. (IT) 2007-11-29 US disclosed
US-20060155077-A1 Tyre for vehicle wheels and elastomeric composition PIRELLI PNEUMATICI S.P.A. (IT) 2006-07-13 US disclosed
EP-0003002-B1 USE OF AROMATIC-ALIPHATIC KETONES AS PHOTOINITIATORS, PHOTOPOLYMERISABLE SYSTEMS CONTAINING SUCH KETONES AND AROMATIC-ALIPHATIC KETONES CIBA-GEIGY AG (CH) 1984-06-13 EP disclosed
US-4321118-A Bis benzoyl sensitizers for photopolymerization or photo cross linking process and composition CIBA-GEIGY CORPORATION (US) 1982-03-23 US disclosed
US-4318791-A PHOTOPOLYMERIZABLE SYSTEM FOR INKS CIBA-GEIGY CORPORATION (US) 1982-03-09 US disclosed
US-4315807-A Sensitizers for photopolymerization CIBA-GEIGY CORPORATION (US) 1982-02-16 US disclosed
US-4308400-A AROMATIC HYDROXY KETONES CIBA-GEIGY A.G. (CH) 1981-12-29 US disclosed
EP-0003002-A2 Use of aromatic-aliphatic ketones as photoinitiators, photopolymerisable systems containing such ketones and aromatic-aliphatic ketones CIBA-GEIGY AG (CH) 1979-07-11 EP disclosed