SCHEMBL4980209

SCHEMBL4980209

O=C(COc1ccc(Cl)cc1)N1CCc2cnc(N3CCN(C4CCC4)CC3)nc2CC1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.52
MAPT P10636 2/20 0.47
HPGD P15428 1/20 0.47
RAB9A P51151 1/20 0.47
HSP90AB1 P08238 1/20 0.47
KDM4E B2RXH2 2/20 0.47
MCHR1 Q99705 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
ALDH1A1 P00352 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
ATF4 P18848 1/20 0.44
ACHE P22303 3/20 0.43
ENPP2 Q13822 2/20 0.43
HRH3 Q9Y5N1 3/20 0.43
KCNH2 Q12809 2/20 0.42

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
SCHEMBL4980557 0.91 KDM4E (0.49) POLBMAPTHPGDHSP90AB1KDM4E
SCHEMBL4976307 0.91 ACHE (0.51) POLBHSP90AB1KDM4EALDH1A1TDP1
SCHEMBL4981561 0.91 HSP90AB1 (0.47) POLBMAPTRAB9AHSP90AB1KDM4E
SCHEMBL4973559 0.91 KDM4E (0.59) POLBMAPTKDM4ESMN1; SMN2ALDH1A1
SCHEMBL4975400 0.91 HRH3 (0.44) POLBRAB9AHSP90AB1KDM4EMCHR1
SCHEMBL4975188 0.90 FKBP1A (0.47) POLBMAPTHSP90AB1KDM4ESMN1; SMN2
SCHEMBL4978172 0.89 KDM4E (0.45) POLBMAPTRAB9AHSP90AB1KDM4E
SCHEMBL4977142 0.89 KDM4E (0.45) POLBMAPTKDM4EMCHR1ALDH1A1
SCHEMBL4978277 0.88 HTT (0.52) MAPTHPGDHSP90AB1KDM4ESMN1; SMN2
SCHEMBL4979123 0.88 SMN1; SMN2 (0.54) POLBMAPTHPGDRAB9AHSP90AB1

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 POLB 1658/4885MAPT 2301/4885HPGD 159/4885

“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.