SCHEMBL5486026

SCHEMBL5486026

FC(F)(F)c1ccc(Nc2ncnc3c2cnn3-c2ccccc2Cl)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 15/20 0.57
TP53 P04637 7/20 0.57
KDM4E B2RXH2 5/20 0.57
HSD17B10 Q99714 4/20 0.57
MEN1 O00255 4/20 0.57
KMT2A Q03164 4/20 0.57
NPC1 O15118 4/20 0.57
RAB9A P51151 4/20 0.57
HTT P42858 3/20 0.57
LMNA P02545 6/20 0.50
THRB P10828 1/20 0.50
HPGD P15428 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
PIP4K2A P48426 1/20 0.49
ALDH1A1 P00352 1/20 0.49
GAA P10253 1/20 0.49
TSHR P16473 1/20 0.49
TRPV1 Q8NER1 1/20 0.48
POLB P06746 1/20 0.47
CYP3A4 P08684 1/20 0.47

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
SCHEMBL5472035 0.89 MAPT (0.57) MAPTTP53KDM4EHSD17B10MEN1
SCHEMBL5489364 0.85 TRPV1 (0.56) MAPTTP53KDM4EHSD17B10MEN1
SCHEMBL14431712 0.85 MAPT (0.53) MAPTTP53KDM4EHSD17B10MEN1
SCHEMBL6266860 0.81 MAPT (0.74) MAPTTP53KDM4EHSD17B10MEN1
SCHEMBL6265786 0.80 MAPT (0.58) MAPTTP53KDM4EHSD17B10MEN1
SCHEMBL6268886 0.79 LMNA (0.73) MAPTTP53KDM4EMEN1KMT2A
SCHEMBL5470970 0.77 TRPV1 (0.53) TRPV1ABL1
SCHEMBL4148677 0.75 TRPV1 (0.54) TRPV1
SCHEMBL5490916 0.75 BCDIN3D (0.46) TRPV1
SCHEMBL5474863 0.74 MAPT (0.53) MAPTTP53KDM4EHSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070197559-A1 Aryl substituted purine analogues NEUROGEN CORPORATION 2007-08-23 US 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-20070197559-A1 Aryl substituted purine analogues ADORA2A, GART, P2RX7 MAPT 4604/4885TP53 3265/4885KDM4E 3890/4885

“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.