SCHEMBL4979554

SCHEMBL4979554

c1ccc2c(CN3CCc4nc(N5CCN(C6CCC6)CC5)ncc4C3)ccnc2c1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.55
LMNA P02545 6/20 0.55
TP53 P04637 3/20 0.55
HSP90AB1 P08238 4/20 0.50
POLB P06746 1/20 0.46
TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL4976928 0.94 MAPT (0.47) MAPTLMNATP53HSP90AB1
SCHEMBL4980399 0.84 MAPT (0.75) MAPTLMNATP53HSP90AB1POLB
SCHEMBL4973632 0.84 MAPT (0.60) MAPTLMNATP53HSP90AB1POLB
SCHEMBL4981551 0.84 HSP90AB1 (0.61) MAPTLMNATP53HSP90AB1POLB
SCHEMBL4978692 0.83 LMNA (0.49) MAPTLMNATP53HSP90AB1POLB
SCHEMBL4974972 0.82 HSP90AB1 (0.52) MAPTLMNATP53HSP90AB1POLB
SCHEMBL4977576 0.82 LMNA (0.65) MAPTLMNATP53HSP90AB1
SCHEMBL4974757 0.80 HSP90AB1 (0.57) MAPTLMNATP53HSP90AB1POLB
SCHEMBL4982017 0.79 MAPT (0.57) MAPTLMNATP53HSP90AB1POLB
SCHEMBL4976381 0.79 MAPT (0.59) MAPTLMNATP53HSP90AB1POLB

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-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
WO-2007146122-A2 TETRAHYDROPYRIDO[3,4-D]PYRIMIDINES AND RELATED ANALOGUES NEUROGEN CORPORATION (US) 2007-12-21 WO 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 MAPT 2301/4885LMNA 4534/4885TP53 1765/4885

“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.