SCHEMBL4980313

SCHEMBL4980313

Fc1cccc(CN2CCc3nc(N4CCN(C5CCC5)CC4)ncc3C2)c1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 3/20 0.60
LMNA P02545 4/20 0.59
MAPT P10636 6/20 0.57
TP53 P04637 3/20 0.52
POLB P06746 1/20 0.52
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
KMT2A Q03164 1/20 0.47
HSD17B10 Q99714 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
SCHEMBL4980665 0.94 HSP90AB1 (0.51) HSP90AB1LMNAMAPTTP53POLB
SCHEMBL4976209 0.89 MAPT (0.59) HSP90AB1LMNAMAPTTP53POLB
SCHEMBL4979825 0.89 HSP90AB1 (0.73) HSP90AB1LMNAMAPTTP53POLB
SCHEMBL4981551 0.88 HSP90AB1 (0.61) HSP90AB1LMNAMAPTTP53POLB
SCHEMBL4974757 0.85 HSP90AB1 (0.57) HSP90AB1LMNAMAPTTP53POLB
SCHEMBL4976228 0.84 LMNA (0.60) HSP90AB1LMNAMAPTTP53POLB
SCHEMBL4973632 0.83 MAPT (0.60) HSP90AB1LMNAMAPTTP53POLB
SCHEMBL4975134 0.83 LMNA (0.76) HSP90AB1LMNAMAPTTP53POLB
SCHEMBL4974972 0.83 HSP90AB1 (0.52) HSP90AB1LMNAMAPTTP53POLB
SCHEMBL4978929 0.82 MAPT (0.51) HSP90AB1LMNAMAPTTP53POLB

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 HSP90AB1 2652/4885LMNA 4534/4885MAPT 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.