SCHEMBL3077908

SCHEMBL3077908

CN1CCC(Oc2cccc(Cl)c2)c2ccc(-c3ncccn3)cc2C1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HRH3 Q9Y5N1 6/20 0.38
SLC6A4 P31645 1/20 0.38
MCHR1 Q99705 2/20 0.38
SLC6A5 Q9Y345 1/20 0.37
SLC6A7 Q99884 1/20 0.36
EGFR P00533 1/20 0.35
FPR2 P25090 1/20 0.35
PROKR1 Q8TCW9 1/20 0.35
DYRK1A Q13627 1/20 0.35
CLK4 Q9HAZ1 1/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GFRA3 O60609 1/20 0.35
RET P07949 1/20 0.35

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
SCHEMBL3083180 0.89 GFRA3 (0.39) HRH3SLC6A4MCHR1DYRK1ACLK4
SCHEMBL3073049 0.88 SSTR4 (0.40) KMT2AHRH3SLC6A4EGFRDYRK1A
SCHEMBL3093495 0.85 SLC6A4 (0.46) MEN1KMT2AHRH3SLC6A4MCHR1
SCHEMBL3079163 0.84 SLC6A4 (0.43) MEN1KMT2AHRH3SLC6A4FPR2
SCHEMBL3088500 0.84 KMT2A (0.35) KMT2ASLC6A4DYRK1ACLK4
SCHEMBL3083522 0.84 KMT2A (0.38) KMT2ASLC6A4SMN1; SMN2
SCHEMBL3084448 0.84 SLC6A2 (0.49) MEN1KMT2AHRH3SLC6A4MCHR1
SCHEMBL3074623 0.83 SSTR4 (0.37) HRH3SLC6A4MCHR1EGFR
SCHEMBL3069530 0.83 ROCK2 (0.42) GFRA3RET
SCHEMBL3087994 0.82 NOS1 (0.40) MEN1KMT2AHRH3SLC6A4MCHR1

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 MEN1 3282/4885KMT2A 1617/4885HRH3 212/4885

“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.