SCHEMBL4978071

SCHEMBL4978071

CCN1CCN(c2ncc3c(n2)CCN(C2=CC=C2)CC3)CC1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 8/20 0.53
HSP90AB1 P08238 3/20 0.50
MAPT P10636 5/20 0.47
TP53 P04637 4/20 0.46
HSP90AA1 P07900 1/20 0.45
POLB P06746 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
SCHEMBL4976218 0.85 LMNA (0.41) LMNAHSP90AB1MAPTTP53POLB
SCHEMBL4978170 0.81 HSP90AA1 (0.49) LMNAHSP90AB1MAPTHSP90AA1
SCHEMBL4979794 0.79 TLR4 (0.39) LMNAHSP90AB1MAPTTP53POLB
SCHEMBL4978066 0.77 LMNA (0.52) LMNAHSP90AB1MAPTTP53HSP90AA1
SCHEMBL4976076 0.76 MAPT (0.61) MAPT
SCHEMBL4976953 0.75 LMNA (0.52) LMNAHSP90AB1MAPTTP53HSP90AA1
SCHEMBL23988187 0.74 LMNA (0.59) LMNAHSP90AB1MAPTTP53HSP90AA1
SCHEMBL4974863 0.74 LMNA (0.52) LMNAHSP90AB1MAPTTP53HSP90AA1
SCHEMBL4975116 0.73 HCRTR1 (0.35) LMNAHSP90AB1MAPTTP53POLB
SCHEMBL4980369 0.71 MAPT (0.40) LMNAHSP90AB1MAPTTP53POLB

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-20080051387-A1 TETRAHYDROPYRIDO[3,4-D]PYRIMIDINES AND RELATED ANALOGUES NEUROGEN CORPORATION 2008-02-28 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-20080051387-A1 TETRAHYDROPYRIDO[3,4-D]PYRIMIDINES AND RELATED ANALOGUES HRH3, HRH4, HRH2 LMNA 4534/4885HSP90AB1 2652/4885MAPT 2301/4885

“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.