SCHEMBL186790

SCHEMBL186790

CC1C=CC[CH]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
SCHEMBL11884356 0.74
SCHEMBL11884351 0.74
SCHEMBL722218 0.74
SCHEMBL722217 0.74
SCHEMBL11884359 0.74
SCHEMBL10774829 0.72
SCHEMBL11705045 0.71
SCHEMBL11479829 0.71
SCHEMBL1178319 0.69
SCHEMBL14420178 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8314271-B2 Selective preparation of some 2-alkoxy-ethanol derivatives FIRMENICH SA (CH) 2012-11-20 US claimed
EP-2200963-B1 SELECTIVE PREPARATION OF SOME 2-ALKOXY-ETHANOL DERIVATIVES FIRMENICH & CIE (CH) 2012-01-04 EP claimed
US-20100197973-A1 SELECTIVE PREPARATION OF SOME 2-ALKOXY-ETHANOL DERIVATIVES FIRMENICH SA (CH) 2010-08-05 US claimed
EP-2200963-A2 SELECTIVE PREPARATION OF SOME 2-ALKOXY-ETHANOL DERIVATIVES Firmenich S.A. (CH) 2010-06-30 EP claimed
WO-2009034510-A2 SELECTIVE PREPARATION OF SOME 2-ALKOXY-ETHANOL DERIVATIVES FIRMENICH SA (CH) 2009-03-19 WO claimed
CN-102319184-B Parakeratosis inhibitor, pore-shrinking agent and external composition for skin SHISEIDO CO LTD 2015-03-25 CN disclosed
US-8937090-B2 Parakeratosis inhibitor, pore-shrinking agent and external composition for skin SHISEIDO COMPANY, LTD. (JP) 2015-01-20 US disclosed
CN-101969920-B Parakeratosis inhibitor, pore shrinking agent or agent for preventing or improving rough skin, and composition for external use on the skin containing the same SHISEIDO CO LTD 2013-09-18 CN disclosed
US-8314271-B2 Selective preparation of some 2-alkoxy-ethanol derivatives FIRMENICH SA (CH) 2012-11-20 US disclosed
US-20120232111-A1 Parakeratosis inhibitor, pore -shrinking agent and external compositon for skin SHISEIDO COMPANY, LTD. (JP) 2012-09-13 US disclosed
US-20120165409-A1 WRINKLE-IMPROVING AGENT SHISEIDO COMPANY, LTD. (JP) 2012-06-28 US disclosed
US-20120070409-A1 TETRACYCLIC FUSED HETEROCYCLIC COMPOUND AND USE THEREOF AS HCV POLYMERASE INHIBITOR JAPAN TOBACCO INC. (JP) 2012-03-22 US disclosed
US-4638071-A ARTIFICIAL SWEETENERS GENERAL FOODS CORPORATION (US) 1987-01-20 US disclosed
US-4636396-A Foodstuff with L-aminodicarboxylic acid gem-diamines GENERAL FOODS CORPORATION (US) 1987-01-13 US disclosed
US-4622417-A DIETETICS GENERAL FOODS CORPORATION (US) 1986-11-11 US disclosed
US-4622418-A LOW CALORIE SWEETENERS GENERAL FOODS CORPORATION (US) 1986-11-11 US disclosed
EP-0199258-A2 L-Aminodicarboxylic acid amides and an edible composition containing same GENERAL FOODS CORPORATION (US) 1986-10-29 EP disclosed
US-4619782-A L-aminodicarboxylic acid gem-diamines GENERAL FOODS CORPORATION (US) 1986-10-28 US disclosed
EP-0186173-A2 L-Aminodicarboxylic-(0-cycloalkyl)-L-aminocarboxylate alkyl esters, an edible composition containing same as sweeteners and a method for sweetening an edible composition GENERAL FOODS CORPORATION (US) 1986-07-02 EP disclosed
US-4572799-A L-Aminodicarboxylic acid amides GENERAL FOODS CORPORATION (US) 1986-02-25 US disclosed