SCHEMBL244184

SCHEMBL244184

CCOC(=O)c1cnc(N2CCOCC2)nc1N

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.66
ALDH1A1 P00352 4/20 0.62
LMNA P02545 2/20 0.62
MAPT P10636 2/20 0.58
ALOX15 P16050 1/20 0.58
PTPN11 Q06124 3/20 0.57
GAA P10253 1/20 0.53
L3MBTL1 Q9Y468 3/20 0.50
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
TP53 P04637 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
PKM P14618 1/20 0.50
USP2 O75604 1/20 0.49
MAPK1 P28482 1/20 0.49
RECQL P46063 1/20 0.49
HSD17B10 Q99714 1/20 0.49
KMT2A Q03164 1/20 0.49
ADORA3 P0DMS8 1/20 0.48

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
SCHEMBL14626136 0.89 MAPT (0.56) KDM4EALDH1A1LMNAMAPTPTPN11
SCHEMBL10322693 0.86 PTPN11 (0.56) KDM4EALDH1A1LMNAMAPTPTPN11
SCHEMBL242697 0.86 KDM4E (0.61) KDM4EALDH1A1LMNAMAPTALOX15
SCHEMBL31254423 0.85 PTPN11 (0.58) KDM4EALDH1A1LMNAMAPTPTPN11
SCHEMBL244096 0.85 KDM4E (0.60) KDM4EALDH1A1LMNAMAPTALOX15
SCHEMBL13696639 0.84 KDM4E (0.59) KDM4EALDH1A1LMNAMAPTALOX15
SCHEMBL31254412 0.84 LMNA (0.56) KDM4EALDH1A1LMNAMAPTPTPN11
SCHEMBL1012134 0.83 KDM4E (0.58) KDM4EALDH1A1LMNAMAPTALOX15
SCHEMBL14590419 0.83 MAPT (0.59) KDM4EALDH1A1LMNAMAPTALOX15
SCHEMBL30503022 0.83 PTPN11 (0.60) KDM4EALDH1A1MAPTPTPN11NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2588473-A1 NITROGEN CONTAINING HETEROCYCLIC COMPOUNDS AS PIK3 -DELTA INHIBITORS Amgen Inc. (US) 2013-05-08 EP disclosed
US-20130079342-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. 2013-03-28 US disclosed
US-20130079342-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. 2013-03-28 US disclosed
US-20130079342-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. 2013-03-28 US disclosed
WO-2012098065-A1 PYRIDO PYRIMIDINES FOR USE AS DYRK1 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2012-07-26 WO disclosed
US-20120184542-A1 PYRIDO PYRIMIDINES ANDERSON KEVIN (US) 2012-07-19 US disclosed
US-20120184542-A1 PYRIDO PYRIMIDINES ANDERSON KEVIN (US) 2012-07-19 US disclosed
US-20120184542-A1 PYRIDO PYRIMIDINES ANDERSON KEVIN (US) 2012-07-19 US disclosed
WO-2012003264-A1 NITROGEN CONTAINING HETEROCYCLIC COMPOUNDS AS PIK3 -DELTA INHIBITORS AMGEN INC. (US) 2012-01-05 WO disclosed
WO-2012003264-A1 NITROGEN CONTAINING HETEROCYCLIC COMPOUNDS AS PIK3 -DELTA INHIBITORS AMGEN INC. (US) 2012-01-05 WO disclosed
US-7160877-B2 Aliphatic nitrogen-containing 5-membered ring compound TANABE SEIYAKU CO., LTD. (JP) 2007-01-09 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 (2 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-20130079342-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, BCL9, MALT1 KDM4E 1400/4885ALDH1A1 3609/4885LMNA 2557/4885
US-20120184542-A1 PYRIDO PYRIMIDINES TYMS, TYMP, DPYD KDM4E 2024/4885ALDH1A1 2619/4885LMNA 1119/4885

“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.