SCHEMBL2402180

SCHEMBL2402180

Nc1cc(NC(=O)c2ccccc2)cc(C(=O)NCC(=O)O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.56
KDM4E B2RXH2 1/20 0.56
HIF1A Q16665 1/20 0.56
SLC22A6 Q4U2R8 1/20 0.56
SLC22A8 Q8TCC7 1/20 0.56
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
FKBP5 Q13451 1/20 0.48
KCNK3 O14649 1/20 0.47
KCNK9 Q9NPC2 1/20 0.47
MAPK1 P28482 1/20 0.46
PKM P14618 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
LMNA P02545 1/20 0.45
GRIN2D O15399 1/20 0.45
GRIN3B O60391 1/20 0.45
GRIN1 Q05586 1/20 0.45
GRIN2A Q12879 1/20 0.45
GRIN2B Q13224 1/20 0.45

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
SCHEMBL2399538 0.88 MAPT (0.56) MAPTKDM4EHIF1ASLC22A6SLC22A8
SCHEMBL2398614 0.85 NPC1 (0.56) MAPTKDM4EHIF1ASLC22A6SLC22A8
SCHEMBL15942885 0.83 KDM4E (0.51) MAPTKDM4EHIF1ASLC22A6SLC22A8
SCHEMBL11780085 0.82 L3MBTL1 (0.67) MEN1KMT2AFKBP5KCNK3KCNK9
SCHEMBL2398642 0.80 KDM4E (0.67) MAPTKDM4EHIF1ASLC22A6SLC22A8
Hippuric Acid SCHEMBL7486 0.78 GAA (0.68) MAPTKDM4EHIF1ASLC22A6SLC22A8
Hippuric Acid SCHEMBL428479 0.78 GAA (0.68) MAPTKDM4EHIF1ASLC22A6SLC22A8
SCHEMBL22030672 0.78 GAA (0.68) MAPTKDM4EHIF1ASLC22A6SLC22A8
SCHEMBL4910550 0.77 KDM4E (0.64) MAPTKDM4EHIF1ASLC22A6SLC22A8
SCHEMBL23782413 0.77 RAB9A (0.68) MAPTKDM4EMEN1KMT2AFKBP5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2386539-B1 4-Aminoproline derivatives useful as lysine mimetics ZEALAND PHARMA AS (DK) 2016-07-20 EP disclosed
EP-1966130-B1 MODIFIED LYSINE-MIMETIC COMPOUNDS ZEALAND PHARMA AS (DK) 2013-12-11 EP disclosed
US-20130225644-A1 MODIFIED LYSINE-MIMETIC COMPOUNDS ZEALAND PHARMA A/S (DK) 2013-08-29 US disclosed
US-8431540-B2 Modified lysine-mimetic compounds ZEALAND PHARMA A/S (DK) 2013-04-30 US disclosed
US-20120245106-A1 MODIFIED LYSINE-MIMETIC COMPOUNDS ZEALAND PHARMA A/S (DK) 2012-09-27 US disclosed
EP-2386539-A2 Modified lysine-mimetic compounds Zealand Pharma A/S (DK) 2011-11-16 EP disclosed
US-D647202-S1 Bone marrow harvesting device WARSAW ORTHOPEDIC, INC. (US) 2011-10-18 US disclosed
US-8026272-B2 Modified lysine-mimetic compounds ZEALAND PHARMA A/S (DK) 2011-09-27 US disclosed
US-20100249206-A1 MODIFIED LYSINE-MIMETIC COMPOUNDS Zealand Pharma A/S and Wyeth 2010-09-30 US disclosed
US-7622496-B2 antiarrhythmia agents; 1-(2-Amino-acetyl)-4-(benzoylamino)-pyrrolidine-2-carboxylic acid; desirable bioavailability properties ZEALAND PHARMA A/S (DK) 2009-11-24 US disclosed
EP-1966130-A2 MODIFIED LYSINE-MIMETIC COMPOUNDS Zealand Pharma A/S (DK) 2008-09-10 EP disclosed
WO-2007078990-A2 MODIFIED LYSINE-MIMETIC COMPOUNDS ZEALAND PHARMA A/S (DK) 2007-07-12 WO disclosed
US-20070149460-A1 Modified lysine-mimetic compounds ZEALAND PHARMA A/S (DK) 2007-06-28 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-20120245106-A1 MODIFIED LYSINE-MIMETIC COMPOUNDS MYLK2, KCNN2, KCNN1 MAPT 3437/4885KDM4E 80/4885HIF1A 4374/4885
US-20130225644-A1 MODIFIED LYSINE-MIMETIC COMPOUNDS MYLK2, KCNN2, KCNN1 MAPT 3437/4885KDM4E 80/4885HIF1A 4374/4885
US-20100249206-A1 MODIFIED LYSINE-MIMETIC COMPOUNDS MYLK2, KCNN2, KCNN1 MAPT 3437/4885KDM4E 80/4885HIF1A 4374/4885
US-20070149460-A1 Modified lysine-mimetic compounds MYLK2, KCNN2, KCNN1 MAPT 3437/4885KDM4E 80/4885HIF1A 4374/4885

“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.