SCHEMBL4976265

SCHEMBL4976265

COc1cc(/C=C/C(=O)N2CCc3cnc(N4CCN(C5CCC5)CC4)nc3CC2)ccc1OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
APP P05067 14/20 0.59
KDM4E B2RXH2 1/20 0.55
MEN1 O00255 1/20 0.55
HPGD P15428 1/20 0.55
KMT2A Q03164 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
BCHE P06276 1/20 0.47
ACHE P22303 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
SCHEMBL4976275 1.00 APP (0.59) APPKDM4EMEN1HPGDKMT2A
SCHEMBL4976734 0.91 KDM4E (0.52) APPKDM4EKMT2ABCHEACHE
SCHEMBL4976717 0.91 KDM4E (0.52) APPKDM4EKMT2ABCHEACHE
SCHEMBL4980672 0.84 ALDH1A1 (0.51) KDM4EMEN1HPGDKMT2A
SCHEMBL4980682 0.84 ALDH1A1 (0.51) KDM4EMEN1HPGDKMT2A
SCHEMBL14190936 0.83 APP (0.79) APPKDM4EMEN1HPGDKMT2A
SCHEMBL4980193 0.83 MEN1 (0.44) MEN1HPGDKMT2ASMN1; SMN2
SCHEMBL4980178 0.83 MEN1 (0.44) MEN1HPGDKMT2ASMN1; SMN2
SCHEMBL4380573 0.83 APP (0.79) APPKDM4EMEN1HPGDKMT2A
SCHEMBL4976994 0.83 HSP90AB1 (0.46) ACHE

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 APP 2424/4885KDM4E 1865/4885MEN1 4419/4885

“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.