SCHEMBL6691925

SCHEMBL6691925

C=C(Br)C1CC1

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
SCHEMBL1661274 0.83
SCHEMBL9061860 0.75 LMNA (0.39)
SCHEMBL7532952 0.67
SCHEMBL6267455 0.67
SCHEMBL23418989 0.64 NOS2 (0.32)
SCHEMBL14000036 0.64
SCHEMBL19047399 0.62
SCHEMBL2959600 0.61
SCHEMBL15272133 0.61
SCHEMBL11880935 0.61

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1261657-B1 POLY(3-CYCLOPROPYL-3-HYDROXYPROPIONATE) AND PROCESSES FOR ITS PREPARATION AND DERIVATIVES THEREOF EASTMAN CHEM CO (US) 2004-11-10 EP disclosed
US-20040210030-A1 Poly(3-cyclopropyl-3-hydroxypropionate) and processes for its preparation and derivatives thereof HUBBS JOHN CLARK (US) 2004-10-21 US disclosed
US-6710206-B2 HEATING TO DEHYDROGENATE AND FORM 3-CYCLOPROPYLACRYLIC ACID; VINYLCYCLOPROPANE AND CYCLOPROPYLACETYLENE PREPARATION EASTMAN CHEMICAL COMPANY 2004-03-23 US disclosed
US-20030212294-A1 Poly(3-cyclopropyl-3-hydroxypropionate) and processes for its preparation and derivatives thereof HUBBS JOHN CLARK (US) 2003-11-13 US disclosed
US-20030208092-A1 Poly(3-cyclopropyl-3-hydroxypropionate) and processes for its preparation and derivatives thereof HUBBS JOHN CLARK (US) 2003-11-06 US disclosed
US-6610878-B1 Catalytic reaction of cyclopropanecarboxaldehyde and ketene; intermediates to vinylcyclopropane, cyclopropylacetylene and cyclopropylacrylic; inexpensive EASTMAN CHEMICAL COMPANY 2003-08-26 US disclosed
EP-1261657-A2 POLY(3-CYCLOPROPYL-3-HYDROXYPROPIONATE) AND PROCESSES FOR ITS PREPARATION AND DERIVATIVES THEREOF EASTMAN CHEMICAL COMPANY (US) 2002-12-04 EP disclosed
US-6297410-B1 1-BROMO-2-CYCLOPROPYLETHYLENE WHICH MAY BE EFFICIENTLY DEHYDROHALOGENATED TO YIELD CYCLOPROPYLACETYLENE, THE CHEMICAL INTERMEDIATE FOR AN HIV REVERSE TRANSCRIPTASE INHIBITOR DUPONT PHARMACEUTICALS COMPANY 2001-10-02 US disclosed
WO-2000068290-A2 POLY(3-CYCLOPROPYL-3-HYDROXYPROPIONATE) AND PROCESSES FOR ITS PREPARATION AND DERIVATIVES THEREOF EASTMAN CHEMICAL COMPANY (US) 2000-11-16 WO disclosed
EP-1000001-A1 A PROCESS FOR THE PREPARATION OF CYCLOPROPYLACETYLENE Dupont Pharmaceuticals Company (US) 2000-05-17 EP disclosed
US-6049019-A Process for the preparation of cyclopropylacetylene DUPONT PHARMACEUTICALS (US) 2000-04-11 US disclosed
WO-1999006341-A1 A PROCESS FOR THE PREPARATION OF CYCLOPROPYLACETYLENE DUPONT PHARMACEUTICALS COMPANY (US) 1999-02-11 WO disclosed
EP-0002263-B1 3-TRIFLUOROMETHYLSULFINYL ANALOGS OF CYPROHEPTADINE, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITION THEREOF MERCK & CO. INC. (US) 1981-10-28 EP disclosed
EP-0002263-A1 3-Trifluoromethylsulfinyl analogs of cyproheptadine, process for their preparation and pharmaceutical composition thereof MERCK & CO. INC. (US) 1979-06-13 EP disclosed
US-4132796-A Antipsychotic 3-trifluoromethylsulfinyl analogs of cyproheptadine MERCK & CO., INC. (US) 1979-01-02 US disclosed
US-4031222-A ANTIEXTRAPYRAMIDAL, ANTIPSYCHOTIC, ENANTIOMERS, TRANQUILIZERS, ANTICHOLINERGIC MERCK & CO., INC. (US) 1977-06-21 US disclosed