Desmedipham

Desmedipham

SCHEMBL3230751

CCOC(=O)Nc1cccc(OC(=O)Nc2ccccc2)c1.COC(=O)Nc1cccc(OC(=O)Nc2cccc(C)c2)c1

nearest known ligand 0.79

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 5/20 0.79
ALDH1A1 P00352 4/20 0.79
FAAH O00519 1/20 0.79
CYP3A4 P08684 1/20 0.79
MTNR1B P49286 1/20 0.58
MAPT P10636 2/20 0.57
HSD17B10 Q99714 2/20 0.57
LMNA P02545 1/20 0.57
RAB9A P51151 3/20 0.55
HPGD P15428 2/20 0.55
NPC1 O15118 2/20 0.55
CRHBP P24387 1/20 0.55
CRHR2 Q13324 1/20 0.55
NPSR1 Q6W5P4 1/20 0.53
KMT2A Q03164 1/20 0.52
BCHE P06276 1/20 0.52
ACHE P22303 1/20 0.52
CYP1A2 P05177 2/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52

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
Desmedipham SCHEMBL4659769 0.98 MAPK1 (0.75) MAPK1ALDH1A1FAAHCYP3A4MTNR1B
SCHEMBL134424 0.93 MAPK1 (0.77) MAPK1ALDH1A1FAAHCYP3A4MTNR1B
SCHEMBL29512574 0.93 MAPK1 (0.77) MAPK1ALDH1A1FAAHCYP3A4MTNR1B
Desmedipham SCHEMBL55084 0.91 MAPK1 (0.68) MAPK1ALDH1A1FAAHCYP3A4MTNR1B
Desmedipham SCHEMBL4895813 0.91 MAPK1 (0.68) MAPK1ALDH1A1FAAHCYP3A4MTNR1B
Desmedipham SCHEMBL29516752 0.91 MAPK1 (0.68) MAPK1ALDH1A1FAAHCYP3A4MTNR1B
Phenmedipham SCHEMBL8489570 0.89 CYP3A4 (1.00) MAPK1ALDH1A1FAAHCYP3A4MAPT
Phenmedipham SCHEMBL29516822 0.89 CYP3A4 (1.00) MAPK1ALDH1A1FAAHCYP3A4MAPT
Phenmedipham SCHEMBL54580 0.89 CYP3A4 (1.00) MAPK1ALDH1A1FAAHCYP3A4MAPT
Phenmedipham SCHEMBL10647210 0.87 CYP3A4 (0.92) MAPK1ALDH1A1FAAHCYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180116209-A1 Liposome Formulations LIPOTEC LABORATORIES LLC 2018-05-03 US disclosed
US-20160270400-A1 Liposome-Attractant Formulations LIPOTEC LABORATORIES LLC 2016-09-22 US disclosed
US-20150150245-A1 LIPSOME FORMULATIONS LIPOTEC LABORATORIES LLC (US) 2015-06-04 US disclosed
US-20100234227-A1 MICROEMULSION CONCENTRATES BAYER CROPSCIENCE AG (DE) 2010-09-16 US disclosed
US-20100048516-A1 PENETRATION ENHANCER FOR FUNGICIDES BAYER CROPSCIENCE AG (DE) 2010-02-25 US disclosed
CN-101621924-A Oil suspension concentrate with micro-encapsulated agrochemical active ingredients BAYER CROPSCIENCE AG 2010-01-06 CN disclosed
CN-101583281-A Penetration enhancer for herbicides and safeners BAYER CROPSCIENCE AG (DE) 2009-11-18 CN disclosed
CN-101562968-A New microemulsion concentrates BAYER CROPSCIENCE AG (DE) 2009-10-21 CN disclosed
CN-101448776-A Glyceride ester derivatives of herbicidal compounds and compositions thereof NUFARM AUSTRALIA LTD (AU) 2009-06-03 CN disclosed
US-20080176746-A1 avoids antagonistically reduced activity or overdosage otherwise requiring split applications; by employing an oil suspension concentrate BAYER CROPSCIENCE AG (DE) 2008-07-24 US disclosed
US-20030208073-A1 Substituted N-aryl nitrogen-containing heterocyclic compounds LINKER KARL-HEINZ (DE) 2003-11-06 US disclosed
US-5022917-A Mixture with nitrogeous compounds MELAMINE CHEMICALS, INC. (US) 1991-06-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100048516-A1 PENETRATION ENHANCER FOR FUNGICIDES DDT, DCPS, TYMP MAPK1 2200/4885ALDH1A1 3150/4885FAAH 2006/4885
US-20030208073-A1 Substituted N-aryl nitrogen-containing heterocyclic compounds NAT1, CYP1B1, CYP1A1 MAPK1 1591/4885ALDH1A1 138/4885FAAH 631/4885
US-20080176746-A1 avoids antagonistically reduced activity or overdosage otherwise requiring split applications; by employing an oil suspension concentrate LIPA, MGLL, ABHD6 MAPK1 4275/4885ALDH1A1 1862/4885FAAH 195/4885
US-20100234227-A1 MICROEMULSION CONCENTRATES ADH1C, MGLL, ADH1A MAPK1 3638/4885ALDH1A1 869/4885FAAH 245/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.