SCHEMBL4157722

SCHEMBL4157722

CCOC(=O)CNc1c2ccccc2nc2ccccc12

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 4/20 0.75
KDM4E B2RXH2 4/20 0.65
POLB P06746 4/20 0.65
GLA P06280 3/20 0.65
ELANE P08246 2/20 0.64
HPGD P15428 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
HSD17B10 Q99714 1/20 0.51
ALDH1A1 P00352 2/20 0.50
GAA P10253 2/20 0.50
RAB9A P51151 2/20 0.50
PDE5A O76074 1/20 0.50
MITF O75030 1/20 0.50
LMNA P02545 1/20 0.50
TTR P02766 1/20 0.50
RAD52 P43351 1/20 0.50
PPID Q08752 1/20 0.50
MAPT P10636 1/20 0.50
RXFP1 Q9HBX9 2/20 0.49
ABCB1 P08183 1/20 0.49

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
SCHEMBL17423141 0.86 TOP2A (0.59) TOP2AKDM4EPOLBGLAELANE
SCHEMBL5796000 0.84 TOP2A (0.56) TOP2AKDM4EPOLBGLAELANE
SCHEMBL9175601 0.80 MEN1 (0.74) KDM4EHPGDSMN1; SMN2ALDH1A1GAA
SCHEMBL9299913 0.80 TOP2A (0.60) TOP2AKDM4EPOLBGLAELANE
SCHEMBL8269887 0.80 SMN1; SMN2 (0.66) TOP2AKDM4EPOLBGLAELANE
SCHEMBL1864822 0.79 POLB (0.61) TOP2AKDM4EPOLBGLAHPGD
SCHEMBL28021796 0.79 TOP2A (0.62) TOP2AKDM4EPOLBGLAELANE
SCHEMBL10363309 0.79 ELANE (1.00) ELANE
SCHEMBL6780160 0.78 KDM4E (0.58) TOP2AKDM4EPOLBGLAELANE
SCHEMBL62893 0.76 POLB (0.60) TOP2AKDM4EPOLBELANEHPGD

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 10 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
US-9127164-B2 Fluorescent dyes and uses thereof ALMAC SCIENCES (SCOTLAND) LIMITED (GB) 2015-09-08 US disclosed
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
US-20090226940-A1 NOVEL FLUORESCENT DYES AND USES THEREOF ITI SCOTLAND LIMITED (GB) 2009-09-10 US disclosed
US-20090226940-A1 NOVEL FLUORESCENT DYES AND USES THEREOF ITI SCOTLAND LIMITED (GB) 2009-09-10 US disclosed
EP-1940965-A2 NOVEL FLUORESCENT DYES AND USES THEREOF ITI Scotland Limited (GB) 2008-07-09 EP disclosed
WO-2007049057-A2 NOVEL FLUORESCENT DYES AND USES THEREOF ITI SCOTLAND LIMITED (GB) 2007-05-03 WO 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 TOP2A 2875/4885KDM4E 4255/4885POLB 3152/4885

“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.