SCHEMBL12210401

SCHEMBL12210401

CC(=O)OC(CC(CC(C)(C)C)NC=O)CC(CC(OC(C)=O)C(C)C)OC(C)=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
SCHEMBL15905673 0.94
SCHEMBL19879375 0.75 TSHR (0.44)
SCHEMBL15984383 0.72 TDP1 (0.40)
SCHEMBL15031021 0.71 TSHR (0.34)
SCHEMBL15905907 0.70 TSHR (0.33)
SCHEMBL12957762 0.70 TSHR (0.42)
SCHEMBL19731163 0.65
SCHEMBL12958786 0.65 TSHR (0.48)
SCHEMBL20310558 0.64 TSHR (0.31)
SCHEMBL15984381 0.62 TDP1 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9452144-B2 Method of using fibrous tissue sealant ACTAMAX SURGICAL MATERIALS, LLC (US) 2016-09-27 US disclosed
US-20150196496-A1 METHOD OF USING FIBROUS TISSUE SEALANT ACTAMAX SURGICAL MATERIALS, LLC (US) 2015-07-16 US disclosed
US-9017703-B2 Method of using fibrous tissue sealant ACTAMAX SURGICAL MATERIALS, LLC (US) 2015-04-28 US disclosed
US-8545871-B2 Fibrous tissue sealant and method of using same ACTAMAX SURGICAL MATERIALS LLC (US) 2013-10-01 US disclosed
US-8466327-B2 Aldehyde-functionalized polyethers and method of making same ACTAMAX SURGICAL MATERIALS, LLC (US) 2013-06-18 US disclosed
US-20110250257-A1 FIBROUS TISSUE SEALANT AND METHOD OF USING SAME ACTAMAX SURGICAL MATERIALS LLC 2011-10-13 US disclosed
US-20100125155-A1 ALDEHYDE-FUNCTIONALIZED POLYETHERS AND METHOD OF MAKING SAME E.I. DU PONT NEMOURS AND COMPANY (US) 2010-05-20 US disclosed