SCHEMBL1353065

SCHEMBL1353065

CN(C)C=Nc1cc(Cl)ccn1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.43
ALDH1A1 P00352 12/20 0.43
KDM4E B2RXH2 11/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
GAA P10253 3/20 0.43
L3MBTL1 Q9Y468 5/20 0.39
MAPT P10636 4/20 0.39
MEN1 O00255 3/20 0.38
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
HSD17B10 Q99714 3/20 0.36
NPSR1 Q6W5P4 2/20 0.36
HPGD P15428 2/20 0.36
HTT P42858 2/20 0.34
MAPK1 P28482 1/20 0.34
HBB P68871 1/20 0.34
POLB P06746 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL1353063 1.00 KMT2A (0.43) KMT2AALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL1355168 0.80 PLAU (0.49) KMT2AALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL1355169 0.80 PLAU (0.49) KMT2AALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL1355073 0.76 NOS3 (0.44) KMT2AALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL21563375 0.76 PLAU (0.53) KMT2AALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL1355074 0.76 NOS3 (0.44) KMT2AALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL17214490 0.75 NOS3 (0.43) KMT2AALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL1355461 0.75 GAA (0.39) KMT2AALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL1355462 0.75 GAA (0.39) KMT2AALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL25967063 0.73 KDM4E (0.39) KMT2AALDH1A1KDM4ESMN1; SMN2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9029393-B2 Adenosine receptor ligands and uses thereof KALDI PHARMA, SAS (FR) 2015-05-12 US disclosed
EP-2391625-B1 New adenosine receptor ligands and uses thereof DOMAIN THERAPEUTICS (FR) 2013-05-01 EP disclosed
EP-2391625-A1 NEW ADENOSINE RECEPTOR LIGANDS AND USES THEREOF Domain Therapeutics (FR) 2011-12-07 EP disclosed
US-20110288074-A1 NEW ADENOSINE RECEPTOR LIGANDS AND USES THEREOF DOMAIN THERAPEUTICS (FR) 2011-11-24 US disclosed
WO-2010084425-A1 NEW ADENOSINE RECEPTOR LIGANDS AND USES THEREOF DOMAIN THERAPEUTICS (FR) 2010-07-29 WO disclosed
EP-2210891-A1 New adenosine receptor ligands and uses thereof Domain Therapeutics (FR) 2010-07-28 EP 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 (1 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-20110288074-A1 NEW ADENOSINE RECEPTOR LIGANDS AND USES THEREOF ADORA2A, ADORA1, ADORA2B KMT2A 1728/4885ALDH1A1 637/4885KDM4E 4203/4885

“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.