SCHEMBL1047067

SCHEMBL1047067

CCN[C@@H](C)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
SCHEMBL3027387 1.00
SCHEMBL14748132 0.78
SCHEMBL7675997 0.78
SCHEMBL12045939 0.74
SCHEMBL10711568 0.74 ADH1B (0.31)
SCHEMBL16384617 0.74
SCHEMBL7678682 0.74
SCHEMBL7674472 0.74
SCHEMBL11009729 0.73
SCHEMBL21185158 0.72 EPHX1 (0.48)

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011032159-A1 METHODS TO PREVENT A HAIR-RELATED SIDE EFFECT OF TREATMENT WITH A CHEMOTHERAPEUTIC AGENT META COMESTICS, LLC (US) 2011-03-17 WO claimed
US-20110002866-A1 METHODS TO PREVENT A HAIR-RELATED SIDE EFFECT OF TREATMENT WITH A CHEMOTHERAPEUTIC AGENT LUBIT BEVERLY W 2011-01-06 US claimed
US-5962686-A FUNGICIDES HOFFMANN-LA ROCHE INC. (US) 1999-10-05 US claimed
US-5900486-A FUNGICIDES HOFFMANN-LA ROCHE INC. (US) 1999-05-04 US claimed
US-5807984-A CONTROLLING DISEASES; PENTAPEPTIDES BASF AKTIENEGESELLSCHAFT (DE) 1998-09-15 US claimed
WO-2011032159-A1 METHODS TO PREVENT A HAIR-RELATED SIDE EFFECT OF TREATMENT WITH A CHEMOTHERAPEUTIC AGENT META COMESTICS, LLC (US) 2011-03-17 WO disclosed
US-20110002866-A1 METHODS TO PREVENT A HAIR-RELATED SIDE EFFECT OF TREATMENT WITH A CHEMOTHERAPEUTIC AGENT LUBIT BEVERLY W 2011-01-06 US disclosed
WO-2010039535-A1 COMPOSITIONS AND METHODS TO TREAT EPITHELIAL-RELATED CONDITIONS META COSMETICS, LLC (US) 2010-04-08 WO disclosed
US-20100074857-A1 COMPOSITIONS AND METHODS TO TREAT EPITHELIAL-RELATED CONDITIONS LIPKIN PAMELA 2010-03-25 US disclosed
WO-2009136290-A1 FUNCTIONALIZED PYRROLIDINES AND USE THEREOF AS IAP INHIBITORS AEGERA THERAPEUTICS, INC. (CA) 2009-11-12 WO disclosed
US-7459561-B2 N-substituted carbamoyloxyalkyl-azolium derivatives BASILEA PHARMACEUTICA AG (CH) 2008-12-02 US disclosed
US-7189858-B2 N-phenyl substituted carbamoyloxyalkyl-azolium derivatives BASILEA PHARMACEUTICA AG (CH) 2007-03-13 US disclosed
EP-1280795-A2 N-SUBSTITUTED CARBAMOYLOXYALKYL-AZOLIUM DERIVATIVES Basilea Pharmaceutica AG (CH) 2003-02-05 EP disclosed
CN-1387529-A N-substd. carbamoyloxyalkyl-azolium derivs. BASLILE PHARMA AG (CH) 2002-12-25 CN disclosed
WO-2001032652-A2 N-SUBSTITUTED CARBAMOYLOXYALKYL-AZOLIUM DERIVATIVES BASILEA PHARMACEUTICA AG (CH) 2001-05-10 WO disclosed
US-5962686-A FUNGICIDES HOFFMANN-LA ROCHE INC. (US) 1999-10-05 US disclosed
US-5900486-A FUNGICIDES HOFFMANN-LA ROCHE INC. (US) 1999-05-04 US disclosed
CN-1182739-A N-benzylazolium derivatives HOFFMANN LA ROCHE (CH) 1998-05-27 CN disclosed
EP-0829478-A2 N-Benzylimidazolium and N-benzyltriazolium derivatives, their preparation and their use as antifungal and antimycotic agents F. HOFFMANN-LA ROCHE AG (CH) 1998-03-18 EP disclosed
EP-0126344-A2 Tripeptide esters of therapeutic agents ABBOTT LABORATORIES (US) 1984-11-28 EP disclosed