SCHEMBL4978237

SCHEMBL4978237

Cc1ccc(CN2CCc3ncnc(N4CCN(C5CCC5)CC4)c3CC2)cc1C

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
LMNA P02545 2/20 0.39
HRH3 Q9Y5N1 2/20 0.39
HRH1 P35367 1/20 0.39
TP53 P04637 2/20 0.38
MAPT P10636 2/20 0.38
TLR7 Q9NYK1 2/20 0.38
TLR9 Q9NR96 1/20 0.37
PDE2A O00408 1/20 0.37
CXCR3 P49682 3/20 0.37
PARP1 P09874 3/20 0.36
TNK2 Q07912 2/20 0.36
TNK1 Q13470 2/20 0.36
ACHE P22303 1/20 0.36
BACE1 P56817 1/20 0.36
KCNH2 Q12809 1/20 0.35
PARP2 Q9UGN5 1/20 0.35

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
SCHEMBL4976444 0.93 MEN1 (0.43) MEN1KMT2ALMNAHRH3HRH1
SCHEMBL4981943 0.89 MEN1 (0.55) MEN1KMT2ALMNAHRH3HRH1
SCHEMBL4974966 0.87 KMT2A (0.46) MEN1KMT2ALMNAHRH3HRH1
SCHEMBL4974790 0.85 HRH3 (0.48) MEN1KMT2ALMNAHRH3HRH1
SCHEMBL4083239 0.85 HRH1 (0.47) MEN1KMT2ALMNAHRH3HRH1
SCHEMBL4978137 0.84 MEN1 (0.43) MEN1KMT2ALMNAHRH3HRH1
SCHEMBL4978459 0.84 L3MBTL3 (0.51) MEN1KMT2AHRH3HRH1MAPT
SCHEMBL4979114 0.84 MEN1 (0.47) MEN1KMT2ALMNAMAPTKCNH2
SCHEMBL4977043 0.83 MEN1 (0.46) MEN1KMT2ALMNAHRH3HRH1
SCHEMBL4976294 0.82 MEN1 (0.54) MEN1KMT2ALMNAHRH3HRH1

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 3 patents. 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
US-20080051387-A1 TETRAHYDROPYRIDO[3,4-D]PYRIMIDINES AND RELATED ANALOGUES NEUROGEN CORPORATION 2008-02-28 US disclosed
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 MEN1 4419/4885KMT2A 1417/4885LMNA 4534/4885

“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.