SCHEMBL3384503

SCHEMBL3384503

CCc1sc2ncnc(C(N)c3ccco3)c2c1-c1ccoc1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 13/20 0.36
BCL2 P10415 3/20 0.36
TDP1 Q9NUW8 1/20 0.35
KDR P35968 3/20 0.35
KIT P10721 1/20 0.35
TEK Q02763 1/20 0.35
BCL2L1 Q07817 2/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ALOX15 P16050 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 1/20 0.33
HIF1A Q16665 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CLK4 Q9HAZ1 1/20 0.33
GAA P10253 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL3386423 0.88 MCL1 (0.41) MCL1BCL2KDRKITTEK
SCHEMBL5792044 0.80 TDP1 (0.42) MCL1BCL2TDP1KDRKIT
SCHEMBL2369044 0.77 MCL1 (0.34) MCL1BCL2TDP1KDRKIT
SCHEMBL3384508 0.76 SMN1; SMN2 (0.58) MCL1BCL2TDP1KDRMEN1
SCHEMBL3387010 0.71 LIMK1 (0.34) TDP1KDRKITTEKMEN1
SCHEMBL2369264 0.68 ADORA1 (0.37) MCL1TDP1MEN1ALDH1A1ALOX15
SCHEMBL6358968 0.67 ADORA1 (0.34)
SCHEMBL5791364 0.67 PTGS1 (0.43) MCL1BCL2KDRKITTEK
SCHEMBL2368435 0.65 MCL1 (0.39) MCL1BCL2KDRKITTEK
SCHEMBL3386427 0.63 SMN1; SMN2 (0.61) MCL1BCL2TDP1BCL2L1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1641803-B3 THIENOPYRIMIDINE DERIVATIVES AS POTASSIUM CHANNEL INHIBITORS XENTION LTD (GB) 2010-12-08 EP disclosed
EP-1641803-B1 THIENOPYRIMIDINE DERIVATIVES AS POTASSIUM CHANNEL INHIBITORS XENTION LTD (GB) 2009-03-18 EP disclosed
EP-1641803-A1 THIENOPYRIMIDINE DERIVATIVES AS POTASSIUM CHANNEL INHIBITORS Xention Discovery Limited (GB) 2006-04-05 EP disclosed
US-20050026935-A1 Compounds XENTION DISCOVERY LTD. 2005-02-03 US disclosed
WO-2004111057-A1 THIENOPYRIMIDINE DERIVATIVES AS POTASSIUM CHANNEL INHIBITORS XENTION DISCOVERY LIMITED (GB) 2004-12-23 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-20050026935-A1 Compounds KCNJ11, KCNJ1, KCNH1 MCL1 3390/4885BCL2 3045/4885TDP1 2898/4885

“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.