SCHEMBL5458210

SCHEMBL5458210

CNC(=O)c1cccc(-c2ccc3c(c2)CCN(C2CCC2)CC3)c1

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 13/20 0.63
L3MBTL3 Q96JM7 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
HRH1 P35367 1/20 0.51
CRBN Q96SW2 1/20 0.48
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
PRMT5 O14744 1/20 0.44
WDR77 Q9BQA1 1/20 0.44
AKR1C3 P42330 1/20 0.43
CREBBP Q92793 1/20 0.43
CYP2D6 P10635 1/20 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
SCHEMBL5457102 0.90 HRH3 (0.73) HRH3L3MBTL3L3MBTL1HRH1CRBN
SCHEMBL1790897 0.87 HRH3 (0.76) HRH3L3MBTL3L3MBTL1HRH1CYP2D6
SCHEMBL5456873 0.84 HRH3 (0.62) HRH3L3MBTL3L3MBTL1HRH1
SCHEMBL5452199 0.83 HRH3 (0.61) HRH3L3MBTL3L3MBTL1HRH1
SCHEMBL5455631 0.83 HRH3 (0.68) HRH3HRH1
SCHEMBL5667538 0.81 HRH3 (0.53) HRH3L3MBTL3L3MBTL1HRH1MEN1
SCHEMBL5660240 0.79 HRH3 (0.72) HRH3L3MBTL3L3MBTL1HRH1CYP2D6
SCHEMBL12748476 0.78 L3MBTL3 (0.43) HRH3L3MBTL3L3MBTL1CRBN
SCHEMBL4764960 0.77 ROCK2 (0.50) HRH3KMT2ACREBBP
SCHEMBL3081481 0.77 HRH3 (1.00) HRH3HRH1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070185089-A1 Benzazepine derivatives for the treatment of neurological and psychiatric disorders GLAXO GROUP LIMITED (GB) 2007-08-09 US claimed
US-20070185089-A1 Benzazepine derivatives for the treatment of neurological and psychiatric disorders GLAXO GROUP LIMITED (GB) 2007-08-09 US disclosed
US-20070185089-A1 Benzazepine derivatives for the treatment of neurological and psychiatric disorders GLAXO GROUP LIMITED (GB) 2007-08-09 US disclosed
US-20070185089-A1 Benzazepine derivatives for the treatment of neurological and psychiatric disorders GLAXO GROUP LIMITED (GB) 2007-08-09 US disclosed
EP-1730114-A1 BENZAZEPINE DERIVATIVES FOR THE TREATMENT OF NEUROLOGICAL AND PSYCHIATRIC DISORDERS GLAXO GROUP LIMITED (GB) 2006-12-13 EP disclosed
WO-2005087746-A1 BENZAZEPINE DERIVATIVES FOR THE TREATMENT OF NEUROLOGICAL AND PSYCHIATRIC DISORDERS GLAXO GROUP LIMITED (GB) 2005-09-22 WO 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-20070185089-A1 Benzazepine derivatives for the treatment of neurological and psychiatric disorders CNR2, GRIN2C, GRIN2B HRH3 38/4885L3MBTL3 3107/4885L3MBTL1 3089/4885

“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.