SCHEMBL4980183

SCHEMBL4980183

CCCc1ccc(C(=O)N2CCc3cnc(N4CCN(C5CCC5)CC4)nc3CC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
HSP90AB1 P08238 2/20 0.47
HRH3 Q9Y5N1 3/20 0.43
USP2 O75604 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSD17B10 Q99714 1/20 0.41
L3MBTL3 Q96JM7 5/20 0.41
L3MBTL1 Q9Y468 5/20 0.41
HSP90AA1 P07900 2/20 0.40
KDM2B Q8NHM5 1/20 0.40
SLC6A7 Q99884 1/20 0.40
HCRTR1 O43613 1/20 0.40
HCRTR2 O43614 1/20 0.40
MBTD1 Q05BQ5 1/20 0.39

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
SCHEMBL4978123 0.95 HSP90AB1 (0.46) MEN1KMT2AHSP90AB1HRH3L3MBTL3
SCHEMBL4979058 0.88 KDM2B (0.53) MEN1KMT2AHSP90AB1HRH3L3MBTL3
SCHEMBL4978516 0.88 HSP90AB1 (0.46) MEN1KMT2AHSP90AB1HRH3KDM2B
SCHEMBL4981523 0.88 HPGD (0.50) MEN1KMT2AHSP90AB1HRH3L3MBTL1
SCHEMBL4976292 0.88 HPGD (0.48) MEN1KMT2AHSP90AB1HRH3NPSR1
SCHEMBL4976638 0.87 HSP90AB1 (0.47) MEN1KMT2AHSP90AB1HRH3L3MBTL3
SCHEMBL4978632 0.86 HSP90AB1 (0.51) HSP90AB1HRH3L3MBTL3L3MBTL1KDM2B
SCHEMBL4978554 0.86 HSP90AB1 (0.63) KMT2AHSP90AB1HRH3HSD17B10L3MBTL3
SCHEMBL4977103 0.86 HSP90AB1 (0.63) MEN1KMT2AHSP90AB1HRH3L3MBTL3
SCHEMBL4976359 0.86 HSP90AB1 (0.52) HSP90AB1HRH3L3MBTL3L3MBTL1KDM2B

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 1417/4885HSP90AB1 2652/4885

“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.