SCHEMBL2188649

SCHEMBL2188649

C/C=C(/CC)C(=O)OO

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
SCHEMBL29055224 1.00
SCHEMBL1277270 1.00
SCHEMBL9126848 0.82
SCHEMBL2229643 0.80 ALDH1A1 (0.39)
SCHEMBL6044981 0.80 GRIK1 (0.35)
SCHEMBL11767085 0.80 GRIK1 (0.38)
SCHEMBL4423141 0.79
SCHEMBL16440995 0.79
SCHEMBL5921557 0.79
SCHEMBL1277052 0.78 NPSR1 (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-2705390-A1 MEDICAL DEVICES HAVING HOMOGENEOUS CHARGE DENSITY AND METHODS FOR MAKING SAME Johnson & Johnson Vision Care Inc. (US) 2014-03-12 EP disclosed
WO-2012151135-A1 MEDICAL DEVICES HAVING HOMOGENEOUS CHARGE DENSITY AND METHODS FOR MAKING SAME JOHNSON & JOHNSON VISION CARE, INC. (US) 2012-11-08 WO disclosed
EP-2342588-A1 IONIC SILICONE HYDROGELS HAVING IMPROVED HYDROLYTIC STABILITY Johnson & Johnson Vision Care, Inc. (US) 2011-07-13 EP disclosed
WO-2010039653-A1 IONIC SILICONE HYDROGELS HAVING IMPROVED HYDROLYTIC STABILITY JOHNSON & JOHNSON VISION CARE, INC. (US) 2010-04-08 WO disclosed