SCHEMBL3074623

SCHEMBL3074623

CN1CCC(Oc2ccccc2Cl)c2ccc(-c3ncccn3)cc2C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 4/20 0.37
SSTR1 P30872 2/20 0.37
MCHR1 Q99705 1/20 0.37
PDE10A Q9Y233 1/20 0.37
SCD O00767 1/20 0.36
SLC6A4 P31645 2/20 0.35
HRH3 Q9Y5N1 1/20 0.35
HTR2B P41595 4/20 0.35
HTR2A P28223 3/20 0.35
HTR2C P28335 3/20 0.35
SCN1A P35498 1/20 0.34
SCN2A Q99250 1/20 0.34
SCN3A Q9NY46 1/20 0.34
HTR1A P08908 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A3 Q01959 1/20 0.34
CHRM2 P08172 3/20 0.34
GHSR Q92847 3/20 0.34
EGFR P00533 2/20 0.34
KCNH2 Q12809 2/20 0.34

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
SCHEMBL3096061 0.90 GSK3B (0.43) SSTR4SSTR1MCHR1SCDSLC6A4
SCHEMBL3093435 0.88 SSTR4 (0.37) SSTR4SLC6A4HTR2BSCN1ASCN2A
SCHEMBL3083174 0.85 SLC6A2 (0.48) SSTR4SSTR1MCHR1SCDSLC6A4
SCHEMBL3083180 0.85 GFRA3 (0.39) MCHR1SLC6A4HRH3HTR2BSCN1A
SCHEMBL3079877 0.84 SLC6A2 (0.45) SSTR4SSTR1PDE10ASCDSLC6A4
SCHEMBL3077920 0.84 SLC6A2 (0.49) SSTR4SSTR1MCHR1SCDSLC6A4
SCHEMBL3077908 0.83 MEN1 (0.39) MCHR1SLC6A4HRH3EGFR
SCHEMBL3078965 0.83 ROCK2 (0.43)
SCHEMBL3083522 0.82 KMT2A (0.38) SLC6A4HTR2BHTR2AHTR1ASLC6A2
SCHEMBL3475116 0.82 NOS1 (0.42) SSTR4SSTR1MCHR1SCDSLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8987252-B2 Aryloxy- and heteroaryloxy-substituted tetrahydrobenzazepines and use thereof to block reuptake of norepinephrine, dopamine, and serotonin ALBANY MOLECULAR RESEARCH, INC. (US) 2015-03-24 US disclosed
US-20100210624-A1 ARYLOXY- AND HETEROARYLOXY-SUBSTITUTED TETRAHYDROBENZAZEPINES AND USE THEREOF TO BLOCK REUPTAKE OF NOREPINEPHRINE, DOPAMINE, AND SEROTONIN ALBANY MOLECULAR RESEARCH, INC. (US) 2010-08-19 US disclosed
EP-2146720-A1 ARYLOXY-AND HETEROARYLOXY-SUBSTITUTED TETRAHYDROBENZAZEPINES AND USE THEREOF TO BLOCK REUPTAKE OF NOREPINEPHRINE, DOPAMINE, AND SEROTONIN AMR Technology, Inc. (US) 2010-01-27 EP disclosed
WO-2008141082-A1 ARYLOXY-AND HETEROARYLOXY-SUBSTITUTED TETRAHYDROBENZAZEPINES AND USE THEREOF TO BLOCK REUPTAKE OF NOREPINEPHRINE, DOPAMINE, AND SEROTONIN AMR TECHNOLOGY, INC. (US) 2008-11-20 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-20100210624-A1 ARYLOXY- AND HETEROARYLOXY-SUBSTITUTED TETRAHYDROBENZAZEPINES AND USE THEREOF TO BLOCK REUPTAKE OF NOREPINEPHRINE, DOPAMINE, AND SEROTONIN ADRA2B, HTR2B, ADRA1B SSTR4 347/4885SSTR1 309/4885MCHR1 112/4885

“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.