SCHEMBL5142328

SCHEMBL5142328

C=C(F)C(=O)OC1(C)CCC(C(C)C)CC1

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
SCHEMBL31149439 0.86 SCN1A (0.30)
SCHEMBL2033523 0.85 TSHR (0.34)
SCHEMBL5006346 0.83 GPR119 (0.30)
SCHEMBL10012080 0.83 GPR119 (0.32)
SCHEMBL4063068 0.79 SCN1A (0.30)
SCHEMBL118103 0.78 ALOX15 (0.34)
SCHEMBL11692287 0.78 OPRL1 (0.32)
SCHEMBL11372188 0.76 SCN1A (0.32)
SCHEMBL5585619 0.75 TSHR (0.34)
SCHEMBL5918195 0.75 TSHR (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1581595-A4 OPTICAL MEMBERS AND POLYMERIZABLE COMPOSITIONS AND THIO COMPOUNDS FOR PRODUCING THEM FUJIFILM CORP (JP) 2007-03-21 EP disclosed
US-20060178457-A1 Optical members and polymerizable compositions and thio compounds for producing them FUJIFILM CORPORATION (JP) 2006-08-10 US disclosed
EP-1581595-A1 OPTICAL MEMBERS AND POLYMERIZABLE COMPOSITIONS AND THIO COMPOUNDS FOR PRODUCING THEM FUJI PHOTO FILM CO., LTD. (JP) 2005-10-05 EP disclosed
WO-2004061009-A1 OPTICAL MEMBERS AND POLYMERIZABLE COMPOSITIONS AND THIO COMPOUNDS FOR PRODUCING THEM FUJI PHOTO FILM CO., LTD. (JP) 2004-07-22 WO disclosed