SCHEMBL2037151

SCHEMBL2037151

O=C(NCc1cccc(CO)n1)NCc1cccc(CO)n1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.61
ADORA2A P29274 3/20 0.49
ADORA1 P30542 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
ALOX15 P16050 1/20 0.44
RAB9A P51151 3/20 0.42
NPC1 O15118 2/20 0.42
P2RX7 Q99572 1/20 0.40
KMT2A Q03164 3/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL23355529 0.90 NPSR1 (0.59) NPSR1ADORA2AADORA1SMN1; SMN2ALOX15
SCHEMBL3747154 0.87 NPSR1 (0.59) NPSR1ADORA2AADORA1SMN1; SMN2ALOX15
SCHEMBL28529109 0.82 NPSR1 (0.59) NPSR1ADORA2AADORA1SMN1; SMN2KMT2A
SCHEMBL13464671 0.81 NPSR1 (0.46) NPSR1ADORA2AADORA1ALOX15KMT2A
SCHEMBL486201 0.78 CCR1 (0.55) NPSR1ADORA2A
SCHEMBL15926179 0.76 NPSR1 (1.00) NPSR1SMN1; SMN2ALOX15RAB9ANPC1
SCHEMBL14076725 0.76 NPSR1 (0.50) NPSR1ADORA2AADORA1
Acetic Acid SCHEMBL6984469 0.75 NPSR1 (0.53) NPSR1ADORA2AALOX15
SCHEMBL9644603 0.74 NPSR1 (0.48) NPSR1ADORA2AADORA1RAB9AP2RX7
SCHEMBL11576989 0.74 NPSR1 (0.47) NPSR1ADORA2AADORA1

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
EP-2511260-B1 AROMATIC COMPOUND, MODIFICATION CARRIER THAT USES SAME AND IS USED FOR SYNTHESIZING AN OLIGONUCLEOTIDE DERIVATIVE, OLIGONUCLEOTIDE DERIVATIVE, AND OLIGONUCLEOTIDE CONSTRUCT UNIV GIFU (JP) 2015-07-29 EP disclosed
EP-2511260-B1 AROMATIC COMPOUND, MODIFICATION CARRIER THAT USES SAME AND IS USED FOR SYNTHESIZING AN OLIGONUCLEOTIDE DERIVATIVE, OLIGONUCLEOTIDE DERIVATIVE, AND OLIGONUCLEOTIDE CONSTRUCT UNIV GIFU (JP) 2015-07-29 EP disclosed
US-8633304-B2 Oligonucleotide derivative comprising an aromatic compound GIFU UNIVERSITY (JP) 2014-01-21 US disclosed
US-8633304-B2 Oligonucleotide derivative comprising an aromatic compound GIFU UNIVERSITY (JP) 2014-01-21 US disclosed
US-8633304-B2 Oligonucleotide derivative comprising an aromatic compound GIFU UNIVERSITY (JP) 2014-01-21 US disclosed
EP-2511260-A1 AROMATIC COMPOUND, MODIFICATION CARRIER THAT USES SAME AND IS USED FOR SYNTHESIZING AN OLIGONUCLEOTIDE DERIVATIVE, OLIGONUCLEOTIDE DERIVATIVE, AND OLIGONUCLEOTIDE CONSTRUCT Gifu University (JP) 2012-10-17 EP disclosed
EP-2511260-A1 AROMATIC COMPOUND, MODIFICATION CARRIER THAT USES SAME AND IS USED FOR SYNTHESIZING AN OLIGONUCLEOTIDE DERIVATIVE, OLIGONUCLEOTIDE DERIVATIVE, AND OLIGONUCLEOTIDE CONSTRUCT Gifu University (JP) 2012-10-17 EP disclosed
US-20120245341-A1 AROMATIC COMPOUND, MODIFICATION CARRIER THAT USES SAME AND IS USED FOR SYNTHESIZING AN OLIGONUCLEOTIDE DERIVATIVE, OLIGONUCLEOTIDE DERIVATIVE, AND OLIGONUCLEOTIDE CONSTRUCT GIFU UNIVERSITY (JP) 2012-09-27 US disclosed
US-20120245341-A1 AROMATIC COMPOUND, MODIFICATION CARRIER THAT USES SAME AND IS USED FOR SYNTHESIZING AN OLIGONUCLEOTIDE DERIVATIVE, OLIGONUCLEOTIDE DERIVATIVE, AND OLIGONUCLEOTIDE CONSTRUCT GIFU UNIVERSITY (JP) 2012-09-27 US disclosed
US-20120245341-A1 AROMATIC COMPOUND, MODIFICATION CARRIER THAT USES SAME AND IS USED FOR SYNTHESIZING AN OLIGONUCLEOTIDE DERIVATIVE, OLIGONUCLEOTIDE DERIVATIVE, AND OLIGONUCLEOTIDE CONSTRUCT GIFU UNIVERSITY (JP) 2012-09-27 US disclosed
WO-2011071078-A1 AROMATIC COMPOUND, MODIFICATION CARRIER THAT USES SAME AND IS USED FOR SYNTHESIZING AN OLIGONUCLEOTIDE DERIVATIVE, OLIGONUCLEOTIDE DERIVATIVE, AND OLIGONUCLEOTIDE CONSTRUCT 国立大学法人岐阜大学 (JP) 2011-06-16 WO disclosed
WO-2011071078-A1 AROMATIC COMPOUND, MODIFICATION CARRIER THAT USES SAME AND IS USED FOR SYNTHESIZING AN OLIGONUCLEOTIDE DERIVATIVE, OLIGONUCLEOTIDE DERIVATIVE, AND OLIGONUCLEOTIDE CONSTRUCT 国立大学法人岐阜大学 (JP) 2011-06-16 WO 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-20120245341-A1 AROMATIC COMPOUND, MODIFICATION CARRIER THAT USES SAME AND IS USED FOR SYNTHESIZING AN OLIGONUCLEOTIDE DERIVATIVE, OLIGONUCLEOTIDE DERIVATIVE, AND OLIGONUCLEOTIDE CONSTRUCT NSUN2, SLCO2A1, ABCB7 NPSR1 2541/4885ADORA2A 160/4885ADORA1 61/4885

“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.