SCHEMBL2168358

SCHEMBL2168358

C[CH]CC1=CC=CCC1=O

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
SCHEMBL1797594 0.82 KDM4E (0.31)
SCHEMBL9425819 0.78
SCHEMBL2173006 0.76
SCHEMBL6764541 0.75
SCHEMBL4354473 0.74
SCHEMBL7532786 0.74
SCHEMBL3118880 0.74
SCHEMBL2053624 0.72
SCHEMBL6971777 0.71 HTR7 (0.30)
SCHEMBL9227224 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2348064-B1 METHOD FOR PRODUCING POLYALKYLENE GLYCOL DERIVATIVES NOF CORP (JP) 2013-08-07 EP claimed
US-8569444-B2 Polyalkylene glycol derivative and process for producing same NOF CORPORATION (JP) 2013-10-29 US disclosed
EP-2348064-B1 METHOD FOR PRODUCING POLYALKYLENE GLYCOL DERIVATIVES NOF CORP (JP) 2013-08-07 EP disclosed
US-20110218322-A1 POLYALKYLENE GLYCOL DERIVATIVE AND PROCESS FOR PRODUCING SAME NOF CORPORATION (JP) 2011-09-08 US disclosed
EP-2348064-A1 POLYALKYLENE GLYCOL DERIVATIVE AND METHOD FOR PRODUCING SAME NOF Corporation (JP) 2011-07-27 EP disclosed