SCHEMBL4606903

SCHEMBL4606903

CCCC(C#CC#CC(CC)CCC)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
SCHEMBL4135230 0.85
SCHEMBL4122212 0.78
SCHEMBL2483605 0.78
SCHEMBL9712644 0.78
SCHEMBL12475355 0.73
SCHEMBL4135232 0.72 TSHR (0.32)
SCHEMBL10901253 0.71 CHRM1 (0.39)
SCHEMBL464424 0.71
SCHEMBL269384 0.71
SCHEMBL378171 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1419815-B1 Phosphine compounds, transition metal complexes with the compounds contained as ligands therein, and asymmetric synthesis catalysts containing the complexes TAKASAGO PERFUMERY CO LTD (JP) 2008-01-09 EP disclosed
US-7078568-B2 Phosphine compounds, transition metal complexes with the compounds contained as ligands therein, and asymmetric synthesis catalysts containing the complexes TAKASAGO INTERNATIONAL CORPORATION (JP) 2006-07-18 US disclosed
US-6987202-B2 Phosphine compounds, transition metal complexes with the compounds contained as ligands therein, and asymmetric synthesis catalysts containing the complexes TAKASAGO INTERNATIONAL CORPORATION (JP) 2006-01-17 US disclosed
US-20050288531-A1 Phosphine compounds, transition metal complexes with the compounds contained as ligands therein, and asymmetric synthesis catalysts containing the complexes SHIMIZU HIDEO 2005-12-29 US disclosed
EP-1419815-A1 Phosphine compounds, transition metal complexes with the compounds contained as ligands therein, and asymmetric synthesis catalysts containing the complexes Takasago International Corporation (JP) 2004-05-19 EP disclosed
US-20040092388-A1 Phosphine compounds, transition metal complexes with the compounds contained as ligands therein, and asymmetric synthesis catalysts containing the complexes TAKASAGO INTERNATIONAL CORPORATION (JP) 2004-05-13 US disclosed