SCHEMBL180477

SCHEMBL180477

CCOC(=O)NCCCCCCCCCCCCN

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 2/20 0.57
ACHE P22303 13/20 0.52
EPHX1 P07099 1/20 0.50
CYP1A2 P05177 1/20 0.47
GNAI3 P08754 1/20 0.46
GNAO1 P09471 1/20 0.46
GNAI1 P63096 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL11572316 1.00 PAOX (0.57) PAOXACHEEPHX1CYP1A2GNAI3
SCHEMBL8971460 0.98 PAOX (0.53) PAOXACHEEPHX1CYP1A2GNAI3
SCHEMBL4030364 0.92 ACHE (0.53) PAOXACHECYP1A2
SCHEMBL1023071 0.90 ACHE (0.61) ACHEEPHX1
SCHEMBL7781306 0.90 ACHE (0.61) ACHEEPHX1
SCHEMBL27712904 0.90 ACHE (0.61) ACHEEPHX1
SCHEMBL12417367 0.90 ACHE (0.61) ACHEEPHX1
SCHEMBL25700463 0.89 ACHE (0.52) PAOXACHEEPHX1
SCHEMBL7570219 0.88 ACHE (0.61) ACHEEPHX1
SCHEMBL18059014 0.85 ACHE (0.49) ACHEEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2401001-B1 ANTI- INFECTIVE FUNCTIONALIZED SURFACES AND METHODS OF MAKING SAME ORTHOBOND CORP (US) 2020-08-12 EP disclosed
CN-104069546-B Anti-infective functionalized surfaces and methods of making same 奥索邦德公司 2020-07-03 CN disclosed
US-10596304-B2 Anti-infective functionalized surfaces and methods of making same Orthobond Corporation (US) 2020-03-24 US disclosed
US-20180099075-A9 ANTI-INFECTIVE FUNCTIONALIZED SURFACES AND METHODS OF MAKING SAME NATIONAL SCIENCE FOUNDATION 2018-04-12 US disclosed
US-20170224882-A1 ANTI-INFECTIVE FUNCTIONALIZED SURFACES AND METHODS OF MAKING SAME ORTHOBOND CORP (US) 2017-08-10 US disclosed
CN-104069546-A Anti-infective functionalized surfaces and methods of making same ORTHOBOND CORP 2014-10-01 CN disclosed
CN-102365103-A Anti-infective functionalized surfaces and methods of making same ORTHOBOND CORP 2012-02-29 CN disclosed
EP-2401001-A1 ANTI- INFECTIVE FUNCTIONALIZED SURFACES AND METHODS OF MAKING SAME Orthobond Corp. (US) 2012-01-04 EP disclosed
WO-2010099221-A1 ANTI- INFECTIVE FUNCTIONALIZED SURFACES AND METHODS OF MAKING SAME ORTHOBOND CORP. (US) 2010-09-02 WO disclosed
US-20100215643-A1 ANTI-INFECTIVE FUNCTIONALIZED SURFACES AND METHODS OF MAKING SAME ORTHOBOND CORP. (US) 2010-08-26 US disclosed