SCHEMBL4980324

SCHEMBL4980324

c1cc(N2CCCC2)ccc1CN1CCc2cnc(N3CCN(C4CCC4)CC3)nc2CC1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.50
POLB P06746 1/20 0.50
L3MBTL3 Q96JM7 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
HSP90AB1 P08238 3/20 0.49
MAPT P10636 5/20 0.48
TP53 P04637 2/20 0.48
TDP1 Q9NUW8 1/20 0.43
HTT P42858 1/20 0.41

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
SCHEMBL4978638 0.93 LMNA (0.59) LMNAPOLBL3MBTL3L3MBTL1HSP90AB1
SCHEMBL4978686 0.89 LMNA (0.64) LMNAPOLBHSP90AB1MAPTTP53
SCHEMBL4979105 0.89 HSP90AB1 (0.62) LMNAPOLBHSP90AB1MAPTTP53
SCHEMBL4978720 0.89 LMNA (0.53) LMNAPOLBHSP90AB1MAPTTP53
SCHEMBL4977885 0.88 LMNA (0.48) LMNAPOLBHSP90AB1MAPTTP53
SCHEMBL4978651 0.86 LMNA (0.51) LMNAPOLBHSP90AB1MAPTTP53
SCHEMBL4976372 0.84 LMNA (0.51) LMNAPOLBHSP90AB1MAPTTP53
SCHEMBL4978255 0.83 TRPV6 (0.53) LMNAPOLBHSP90AB1MAPTTP53
SCHEMBL4980704 0.83 LMNA (0.46) LMNAPOLBHSP90AB1MAPTTP53
SCHEMBL4979825 0.82 HSP90AB1 (0.73) LMNAPOLBHSP90AB1MAPTTP53

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 LMNA 4534/4885POLB 1658/4885L3MBTL3 2564/4885

“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.