SCHEMBL4978182

SCHEMBL4978182

Cc1cccc(OC(C)C(=O)N2CCc3cnc(N4CCN(C5CCC5)CC4)nc3CC2)c1C

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
MAPT P10636 2/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HSP90AB1 P08238 4/20 0.38
HSP90AA1 P07900 4/20 0.38
HCRTR1 O43613 1/20 0.37
HCRTR2 O43614 1/20 0.37
TP53 P04637 1/20 0.37
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
OGA O60502 1/20 0.36
KDM2B Q8NHM5 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL4976501 0.94 MEN1 (0.45) LMNAMAPTMEN1KMT2AHSP90AB1
SCHEMBL4974605 0.88 ALDH1A1 (0.46) MAPTMEN1KMT2AHSP90AB1HSP90AA1
SCHEMBL4976452 0.86 PTPN11 (0.42) MAPTKMT2AHSP90AB1HSP90AA1HCRTR1
SCHEMBL4975411 0.85 MEN1 (0.47) LMNAMAPTMEN1KMT2AHSP90AB1
SCHEMBL4978678 0.84 HRH3 (0.44) MAPTHSP90AB1HSP90AA1OGAKDM2B
SCHEMBL4980624 0.83 ALDH1A1 (0.49) LMNAMAPTMEN1KMT2AHSP90AB1
SCHEMBL4975230 0.83 HSP90AB1 (0.45) MAPTKMT2AHSP90AB1HSP90AA1ALDH1A1
SCHEMBL4976881 0.82 GBA1 (0.46) LMNAHSP90AB1HSP90AA1HCRTR1HCRTR2
SCHEMBL4978771 0.81 HSP90AA1 (0.46) MAPTHSP90AB1HSP90AA1HCRTR1HCRTR2
SCHEMBL4981962 0.81 KDM2B (0.41) LMNAMAPTMEN1KMT2AHSP90AB1

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 4534/4885MAPT 2301/4885MEN1 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.