SCHEMBL2402016

SCHEMBL2402016

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

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.65
MEN1 O00255 6/20 0.65
L3MBTL1 Q9Y468 2/20 0.63
PKM P14618 1/20 0.63
POLB P06746 2/20 0.58
KCNK3 O14649 1/20 0.57
KCNK9 Q9NPC2 1/20 0.57
GAA P10253 1/20 0.54
FKBP5 Q13451 1/20 0.52
FABP1 P07148 1/20 0.52
P2RY14 Q15391 1/20 0.52
FFAR1 O14842 1/20 0.51
SIRT1 Q96EB6 1/20 0.51
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
NR1H4 Q96RI1 1/20 0.50
HPSE Q9Y251 1/20 0.50

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
SCHEMBL2400768 0.86 KMT2A (0.63) KMT2AMEN1L3MBTL1PKMPOLB
SCHEMBL6866111 0.85 L3MBTL1 (0.85) KMT2AMEN1L3MBTL1PKMPOLB
SCHEMBL26482849 0.81 KMT2A (0.57) KMT2AMEN1L3MBTL1PKMPOLB
SCHEMBL22305399 0.81 KCNK3 (0.83) KMT2AMEN1L3MBTL1PKMPOLB
SCHEMBL9912441 0.80 NPC1 (0.58) KMT2AMEN1L3MBTL1POLBNPC1
SCHEMBL14758994 0.78 L3MBTL1 (1.00) KMT2AMEN1L3MBTL1PKMPOLB
SCHEMBL11780085 0.78 L3MBTL1 (0.67) KMT2AMEN1L3MBTL1PKMPOLB
SCHEMBL6265712 0.77 L3MBTL1 (0.78) KMT2AMEN1L3MBTL1PKMPOLB
SCHEMBL2401923 0.76 MEN1 (0.55) KMT2AMEN1L3MBTL1PKMPOLB
SCHEMBL679144 0.76 KMT2A (0.90) KMT2AMEN1L3MBTL1PKMPOLB

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 KMT2A 89/4885MEN1 1114/4885L3MBTL1 112/4885
US-20130225644-A1 MODIFIED LYSINE-MIMETIC COMPOUNDS MYLK2, KCNN2, KCNN1 KMT2A 89/4885MEN1 1114/4885L3MBTL1 112/4885
US-20100249206-A1 MODIFIED LYSINE-MIMETIC COMPOUNDS MYLK2, KCNN2, KCNN1 KMT2A 89/4885MEN1 1114/4885L3MBTL1 112/4885
US-20070149460-A1 Modified lysine-mimetic compounds MYLK2, KCNN2, KCNN1 KMT2A 89/4885MEN1 1114/4885L3MBTL1 112/4885

“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.