SCHEMBL13697268

SCHEMBL13697268

CC(=O)Nc1ccc2nc3ccc(NC(C)=O)cc3c(N)c2c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.61
KDM4E B2RXH2 4/20 0.61
MEN1 O00255 4/20 0.61
NPC1 O15118 4/20 0.61
MAPT P10636 3/20 0.61
RAB9A P51151 3/20 0.61
PABPC1 P11940 1/20 0.61
GLA P06280 1/20 0.60
TNNI3 P19429 1/20 0.60
TNNT2 P45379 1/20 0.60
TNNC1 P63316 1/20 0.60
RUNX1 Q01196 1/20 0.60
CBFB Q13951 1/20 0.60
GNG2 P59768 2/20 0.54
GNB1 P62873 2/20 0.54
MMP1 P03956 1/20 0.54
MMP9 P14780 1/20 0.54
ALOX15 P16050 1/20 0.54
BLM P54132 1/20 0.54
LMNA P02545 3/20 0.51

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
SCHEMBL13696892 0.94 KMT2A (0.55) KMT2AKDM4EMEN1NPC1MAPT
SCHEMBL4163110 0.93 KMT2A (0.66) KMT2AKDM4EMEN1NPC1MAPT
SCHEMBL4163695 0.87 KDM4E (0.65) KMT2AKDM4EMEN1NPC1MAPT
SCHEMBL13697360 0.87 ABCG2 (0.55) KMT2AKDM4EMEN1NPC1MAPT
SCHEMBL4159315 0.83 KDM4E (0.66) KMT2AKDM4EMEN1NPC1MAPT
SCHEMBL4157750 0.81 KDM4E (0.58) KMT2AKDM4EMEN1NPC1MAPT
SCHEMBL7763069 0.81 GNG2 (0.81) KMT2AMEN1MAPTGNG2GNB1
SCHEMBL15624395 0.81 KMT2A (0.51) KMT2AKDM4EMEN1NPC1MAPT
SCHEMBL9874880 0.78 KDM4E (0.55) KMT2AKDM4EMEN1NPC1MAPT
SCHEMBL9737181 0.77 ACHE (0.53) KMT2AKDM4EMEN1NPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9127164-B2 Fluorescent dyes and uses thereof ALMAC SCIENCES (SCOTLAND) LIMITED (GB) 2015-09-08 US disclosed
EP-1940965-B1 NOVEL FLUORESCENT DYES AND USES THEREOF ALMAC SCIENCES SCOTLAND LTD (GB) 2014-03-26 EP disclosed
US-20090226940-A1 NOVEL FLUORESCENT DYES AND USES THEREOF ITI SCOTLAND LIMITED (GB) 2009-09-10 US disclosed
WO-2007049057-A2 NOVEL FLUORESCENT DYES AND USES THEREOF ITI SCOTLAND LIMITED (GB) 2007-05-03 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-20090226940-A1 NOVEL FLUORESCENT DYES AND USES THEREOF ACR, ANXA5, GLB1 KMT2A 4502/4885KDM4E 4255/4885MEN1 3393/4885

“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.