SCHEMBL3333692

SCHEMBL3333692

N#Cc1ccc(Oc2ccc3c(c2)CCC(C2=CC=C2)NC3)nc1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.47
HRH3 Q9Y5N1 15/20 0.41
OPRM1 P35372 1/20 0.36
HRH1 P35367 1/20 0.33
DRD2 P14416 1/20 0.33
DRD3 P35462 1/20 0.33
FAAH O00519 1/20 0.32

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
SCHEMBL3333687 0.80 PDE4B (0.48) PDE4BHRH3OPRM1HRH1
SCHEMBL6261972 0.76 HRH3 (0.47) HRH3HRH1FAAH
SCHEMBL3089908 0.74 PDE4B (0.48) PDE4BHRH3OPRM1HRH1
SCHEMBL6268381 0.71 HRH3 (0.48) HRH3HRH1
SCHEMBL3089905 0.70 HRH3 (0.65) HRH3HRH1
SCHEMBL3653092 0.66 HRH3 (0.52) PDE4BHRH3
SCHEMBL4363971 0.66 SLC8A1 (0.56)
SCHEMBL8306759 0.66 PDE4B (0.52) PDE4BOPRM1
SCHEMBL4366489 0.65 SLC8A1 (0.48) PDE4B
SCHEMBL3334368 0.65 HRH3 (0.51) HRH3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8207331-B2 Benzazepine derivatives for the treatment of neurological disorders GLAXO GROUP LIMITED (GB) 2012-06-26 US disclosed
US-20100145040-A1 Benzazepine Derivatives For The Treatment of Neurological Disorders GLAXO GROUP LIMITED 2010-06-10 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-20100145040-A1 Benzazepine Derivatives For The Treatment of Neurological Disorders GRIN2C, GRIN2A, GRIN2B PDE4B 1098/4885HRH3 450/4885OPRM1 794/4885

“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.