SCHEMBL3973408

SCHEMBL3973408

CC1(C(F)(F)F)CO1

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
SCHEMBL6119389 1.00
SCHEMBL25738156 0.81 CHRM2 (0.31)
SCHEMBL27225779 0.78
SCHEMBL10820230 0.75
SCHEMBL24653609 0.75
SCHEMBL13856024 0.75
SCHEMBL11109279 0.73
SCHEMBL20869656 0.69
SCHEMBL14224329 0.69
SCHEMBL2114500 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0575785-B1 3,4-dimethyl-2,5,6-tris/p-sulfonatophenyl)-1-phosphanorbornadiene, process for its preparation and process for hydroformulation of olefinic unsaturated compounds HOECHST AG (DE) 1997-01-08 EP claimed
US-20240158392-A1 SMALL MOLECULE INHIBITORS OF SALT INDUCIBLE KINASES JANSSEN RESEARCH & DEVELOPMENT, LLC 2024-05-16 US disclosed
US-11845752-B2 Substituted imidazo[1,5-a]pyrazines for the treatment of hepatitis B ALIGOS THERAPEUTICS, INC. (US) 2023-12-19 US disclosed
EP-4284801-A1 SMALL MOLECULE INHIBITORS OF SALT INDUCIBLE KINASES Janssen Biotech, Inc. (US) 2023-12-06 EP disclosed
US-20230339970-A1 CASEIN KINASE 1 DELTA MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2023-10-26 US disclosed
EP-4229062-A1 BICYCLIC COMPOUNDS Aligos Therapeutics, Inc. (US) 2023-08-23 EP disclosed
EP-4214214-A1 CASEIN KINASE 1 DELTA MODULATORS JANSSEN Pharmaceutica NV (BE) 2023-07-26 EP disclosed
US-11710854-B2 Functional epoxides in catalyst-based electrolyte compositions for Li-ion batteries ENEVATE CORPORATION (US) 2023-07-25 US disclosed
US-11710854-B2 Functional epoxides in catalyst-based electrolyte compositions for Li-ion batteries ENEVATE CORPORATION (US) 2023-07-25 US disclosed
US-11472791-B2 Pyrazolyl pyrimidinylamine compounds as CDK2 inhibitors INCYTE CORPORATION (US) 2022-10-18 US disclosed
US-6020451-A Compositions of polytetramethylene ether glycols and polyoxy alkylene polyether polyols having a low degree of unsaturation BASF CORPORATION (US) 2000-02-01 US disclosed
US-5998574-A BLENDS BASF CORPORATION (US) 1999-12-07 US disclosed
EP-0850258-A1 COMPOSITIONS OF POLYTETRAMETHYLENE ETHER GLYCOLS AND POLYOXY ALKYLENE POLYETHER POLYOLS HAVING A LOW DEGREE OF UNSATURATION BASF CORPORATION (US) 1998-07-01 EP disclosed
WO-1998001492-A1 COMPOSITIONS OF POLYTETRAMETHYLENE ETHER GLYCOLS AND POLYOXY ALKYLENE POLYETHER POLYOLS HAVING A LOW DEGREE OF UNSATURATION BASF CORPORATION (DE) 1998-01-15 WO disclosed
US-5690909-A USEFUL AS NMR AND X-RAY DIAGNOSTIC AGENTS SCHERING AKTIENGESELLSCHAFT (DE) 1997-11-25 US disclosed
EP-0700393-B1 MACROCYCLIC METAL COMPLEXES CONTAINING FLUORINE SCHERING AG (DE) 1997-10-22 EP disclosed
EP-0700393-A1 MACROCYCLIC METAL COMPLEXES CONTAINING FLUORINE SCHERING AG (DE) 1996-03-13 EP disclosed
WO-1994027978-A1 MACROCYCLIC METAL COMPLEXES CONTAINING FLUORINE SCHERING AKTIENGESELLSCHAFT (DE) 1994-12-08 WO disclosed
US-4568775-A FROM TETRAHYDROFURAN IN PRESENCE OF HETEROPOLY-ACID CATALYST ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1986-02-04 US disclosed
EP-0126471-A2 Process for producing polyetherglycol Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1984-11-28 EP disclosed