SCHEMBL5451394

SCHEMBL5451394

CCN(CC)c1nc(Nc2cc(OC)ccc2OC)nc(N2CCN(c3ccccn3)CC2)n1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.59
MAPK1 P28482 3/20 0.59
GBA1 P04062 4/20 0.50
HTT P42858 3/20 0.47
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
NPSR1 Q6W5P4 2/20 0.46
KIT P10721 1/20 0.44
FLT3 P36888 1/20 0.44
IRAK4 Q9NWZ3 1/20 0.44
LMNA P02545 3/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
GALR1 P47211 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL3884151 0.84 ALDH1A1 (0.50) ALDH1A1KDM4EL3MBTL1NPSR1LMNA
SCHEMBL3243327 0.78 ALDH1A1 (0.48) MAPTMAPK1GBA1HTTALDH1A1
SCHEMBL5442152 0.77 MAPK1 (0.58) MAPTMAPK1ALDH1A1KDM4ENPSR1
SCHEMBL5456665 0.76 MAPK1 (0.46) MAPTMAPK1ALDH1A1KDM4ELMNA
SCHEMBL5448937 0.71 GBA1 (0.48) MAPTMAPK1GBA1HTTL3MBTL1
SCHEMBL3879137 0.71 MAPT (0.44) MAPTALDH1A1KDM4ELMNAMEN1
SCHEMBL32687782 0.70 MAPT (0.82) MAPTMAPK1GBA1HTTNPSR1
SCHEMBL4040889 0.70 FLT3 (0.78) KITFLT3IRAK4NPC1RAB9A
SCHEMBL3236694 0.68 MAPT (0.56) MAPTMAPK1GBA1HTTALDH1A1
SCHEMBL5383100 0.67 MAPT (0.59) MAPTMAPK1GBA1HTTALDH1A1

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-20070043049-A1 Substituted heterocyclic diarylamine analogues NEUROGEN CORPORATION (US) 2007-02-22 US claimed
US-20070043049-A1 Substituted heterocyclic diarylamine analogues NEUROGEN CORPORATION (US) 2007-02-22 US disclosed
US-20070043049-A1 Substituted heterocyclic diarylamine analogues NEUROGEN CORPORATION (US) 2007-02-22 US disclosed
US-20070043049-A1 Substituted heterocyclic diarylamine analogues NEUROGEN CORPORATION (US) 2007-02-22 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-20070043049-A1 Substituted heterocyclic diarylamine analogues GPR35, NPY1R, BDKRB1 MAPT 4826/4885MAPK1 2316/4885GBA1 1038/4885

“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.