SCHEMBL3386233

SCHEMBL3386233

Fc1ccc(N2CCc3nc(OCCCN4CCCC4)ccc3C2)nc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.43
DRD1 P21728 3/20 0.43
DRD5 P21918 3/20 0.43
DRD3 P35462 3/20 0.43
HRH3 Q9Y5N1 8/20 0.41
SLC6A4 P31645 1/20 0.41
SIGMAR1 Q99720 2/20 0.39
TMEM97 Q5BJF2 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
HTR1A P08908 1/20 0.38
ADRA2C P18825 1/20 0.38
HTR2A P28223 1/20 0.38
HTR7 P34969 1/20 0.38
HRH1 P35367 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP1A2 P05177 1/20 0.37

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
SCHEMBL3385475 0.88 DRD2 (0.47) DRD2DRD1DRD5DRD3HRH3
SCHEMBL3389254 0.88 TMEM97 (0.43) DRD2DRD3HRH3SLC6A4SIGMAR1
SCHEMBL3388534 0.87 TIPARP (0.41) DRD2DRD1DRD3HRH3HTR7
SCHEMBL13652075 0.86 HRH3 (0.39) DRD2DRD1DRD5DRD3HRH3
SCHEMBL3431665 0.85 HRH3 (0.46) HRH3HTR7HRH1TIPARPACHE
SCHEMBL3434200 0.84 OPRM1 (0.48) HRH3
SCHEMBL3389354 0.83 GRIN2D (0.47) DRD2DRD1DRD5DRD3HRH3
SCHEMBL3387521 0.83 HRH3 (0.39) HRH3SLC6A4
SCHEMBL3384977 0.83 OPRM1 (0.47) HRH3
SCHEMBL3389303 0.82 GRIN2D (0.46) DRD2DRD1DRD5DRD3HRH3

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-7557121-B2 Tetrahydronaphthyridine derivatives PFIZER INC (US) 2009-07-07 US claimed
US-20050256135-A1 Tetrahydronaphthyridine derivatives LUNN GRAHAM 2005-11-17 US claimed
EP-1756104-B1 TETRAHYDRONAPHTHYRIDINE DERIVATIVES USEFUL AS HISTAMINE H3 RECEPTOR LIGANDS PFIZER LTD (GB) 2010-12-15 EP 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-20050256135-A1 Tetrahydronaphthyridine derivatives HRH4, HRH3, HRH1 DRD2 169/4885DRD1 234/4885DRD5 415/4885

“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.