SCHEMBL9322003

SCHEMBL9322003

O=C(O)CC(CC(CC(CC(=O)O)N1CC1)(CC(CC(=O)O)N1CC1)C(CO)(CO)CCO)N1CC1

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
SCHEMBL11385435 0.75
SCHEMBL244677 0.75
SCHEMBL1255080 0.73
SCHEMBL537212 0.66 OR51E2 (0.41)
SCHEMBL14796467 0.65 RNPEP (0.34)
SCHEMBL500155 0.65 DPP7 (0.35)
SCHEMBL21124671 0.65
SCHEMBL22060499 0.65 IDO1 (0.41)
SCHEMBL9959052 0.65 FOLH1 (0.31)
SCHEMBL540504 0.64 ALDH1A1 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0438886-B1 Water- and oil-repellent treatment agent MINNESOTA MINING & MFG (US) 1994-02-02 EP claimed
US-5084191-A Fibers with oil and water repellants of fluorochemicals, aziri dines and metal alcoholates or esters and drying MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1992-01-28 US claimed
EP-0438886-A1 Water- and oil-repellent treatment agent MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-07-31 EP claimed
US-20160024297-A1 RESIN COMPOSITION AND RESIN MOLDED ARTICLE FUJI XEROX CO., LTD. (JP) 2016-01-28 US disclosed
US-5284902-A Copolymer from fluoroaliphatic radical-containing monomer and non-fluorinated (meth)acrylate monomer, and fluoroaliphatic radical-containing ester MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-02-08 US disclosed
EP-0438886-B1 Water- and oil-repellent treatment agent MINNESOTA MINING & MFG (US) 1994-02-02 EP disclosed
US-5084191-A Fibers with oil and water repellants of fluorochemicals, aziri dines and metal alcoholates or esters and drying MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1992-01-28 US disclosed
EP-0438886-A1 Water- and oil-repellent treatment agent MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-07-31 EP disclosed