SCHEMBL4174555

SCHEMBL4174555

O=C1NC(=O)C(Cc2ccccc2)(Cc2ccccc2)N1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.49
ADAM17 P78536 2/20 0.49
ALDH1A1 P00352 3/20 0.47
MAPT P10636 2/20 0.47
CYP2C9 P11712 2/20 0.47
CACNA1F O60840 1/20 0.47
HTR2A P28223 1/20 0.47
HRH1 P35367 1/20 0.47
SCN1A P35498 1/20 0.47
SCN4A P35499 1/20 0.47
BLM P54132 1/20 0.47
PMP22 Q01453 1/20 0.47
CACNA1D Q01668 1/20 0.47
KCNH2 Q12809 1/20 0.47
CACNA1S Q13698 1/20 0.47
CACNA1C Q13936 1/20 0.47
SCN5A Q14524 1/20 0.47
SCN2A Q99250 1/20 0.47
SCN3A Q9NY46 1/20 0.47
MMP9 P14780 6/20 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
SCHEMBL7696985 0.85 MMP9 (0.49) CYP3A4ADAM17ALDH1A1MAPTCYP2C9
SCHEMBL7097777 0.77 ALDH1A1 (0.60) CYP3A4ADAM17ALDH1A1MAPTCYP2C9
SCHEMBL6938729 0.77 MMP9 (0.47) CYP3A4ADAM17ALDH1A1MAPTCYP2C9
SCHEMBL15972776 0.77 ALDH1A1 (0.60) CYP3A4ADAM17ALDH1A1MAPTCYP2C9
SCHEMBL11570838 0.77 CYP3A4 (0.47) CYP3A4ADAM17ALDH1A1MAPTCYP2C9
SCHEMBL5448618 0.77 MMP9 (0.64) CYP3A4ADAM17ALDH1A1MAPTCYP2C9
SCHEMBL9047819 0.77 ALDH1A1 (0.56) CYP3A4ADAM17ALDH1A1MAPTCYP2C9
SCHEMBL14935449 0.77 ALDH1A1 (0.46) ALDH1A1MAPTCYP2C9CACNA1FHTR2A
SCHEMBL8661339 0.77 ALDH1A1 (0.42) CYP3A4ADAM17ALDH1A1MAPTCYP2C9
SCHEMBL5180824 0.76 ADAM17 (0.79) CYP3A4ADAM17ALDH1A1MAPTCYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1674526-B9 POLYACETAL RESIN COMPOSITION POLYPLASTICS CO (JP) 2013-05-29 EP disclosed
EP-1674526-B1 POLYACETAL RESIN COMPOSITION POLYPLASTICS CO (JP) 2012-12-05 EP disclosed
EP-1679346-B1 POLYACETAL RESIN COMPOSITION POLYPLASTICS CO (JP) 2012-11-14 EP disclosed
US-7638565-B2 Polyacetal resin composition POLYPLASTICS CO., LTD. (JP) 2009-12-29 US disclosed
US-20090143506-A1 Aldehyde inhibitor composition and polyacetal resin composition POLYPLASTICS CO., LTD. (JP) 2009-06-04 US disclosed
US-7345022-B2 Anti-fibril peptides BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2008-03-18 US disclosed
US-20070123617-A1 Polyacetal resin composition DEUTSCHE BANK AG, NEW YORK BRANCH, AS COLLATERAL AGENT 2007-05-31 US disclosed
US-20070054998-A1 Polyacetal resin composition POLYPLASTICS CO., LTD. (JP) 2007-03-08 US disclosed
US-20070032605-A1 Polyacetal resin composition POLYPLASTICS CO., LTD. (JP) 2007-02-08 US disclosed
EP-1686156-A1 POLYACETAL RESIN COMPOSITION Polyplastics Co., Ltd. (JP) 2006-08-02 EP disclosed
EP-1683838-A1 ALDEHYDE INHIBITOR COMPOSITION AND POLYACETAL RESIN COMPOSITION Polyplastics Co., Ltd. (JP) 2006-07-26 EP disclosed
EP-1679346-A1 POLYACETAL RESIN COMPOSITION Polyplastics Co., Ltd. (JP) 2006-07-12 EP disclosed
EP-1674526-A1 POLYACETAL RESIN COMPOSITION Polyplastics Co., Ltd. (JP) 2006-06-28 EP disclosed
US-20050119187-A1 Blocking toxicity of amyloid peotide; Alzheimer's, Parkinson's disease; sleep disorders; antidiabetic agents BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE 2005-06-02 US disclosed
US-4745189-A Method of preparing N-halogenated organic heterocyclic compounds ETHYL CORPORATION (US) 1988-05-17 US disclosed