SCHEMBL1633115

SCHEMBL1633115

CC(C)(C)N(CC1CNCCO1)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 5/20 0.35
SLC6A2 P23975 10/20 0.33
SLC6A3 Q01959 7/20 0.33
SLC6A4 P31645 6/20 0.33
ADRB2 P07550 1/20 0.33
HTR1A P08908 1/20 0.33
HTR2A P28223 1/20 0.33
ADRA1A P35348 1/20 0.33
HTR2B P41595 1/20 0.33
ADRA2C P18825 1/20 0.33
BRD4 O60885 1/20 0.31
CHEK1 O14757 1/20 0.30

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
SCHEMBL3102536 1.00 SSTR4 (0.35) SSTR4SLC6A2SLC6A3SLC6A4ADRB2
SCHEMBL2767957 1.00 SSTR4 (0.35) SSTR4SLC6A2SLC6A3SLC6A4ADRB2
SCHEMBL17200854 0.87 SSTR4 (0.35) SSTR4SLC6A2SLC6A3SLC6A4ADRB2
SCHEMBL17448116 0.80 SLC6A2 (0.35) SSTR4SLC6A2SLC6A3SLC6A4ADRB2
SCHEMBL17448117 0.80 SLC6A2 (0.35) SSTR4SLC6A2SLC6A3SLC6A4ADRB2
SCHEMBL4302670 0.78 LMNA (0.34) BRD4
SCHEMBL5725934 0.77 ALDH1A1 (0.33)
SCHEMBL17094524 0.77 ALDH1A1 (0.33)
SCHEMBL15193782 0.77 ALDH1A1 (0.33)
SCHEMBL21111181 0.74 SLC6A2 (0.34) SSTR4SLC6A2SLC6A3SLC6A4ADRB2

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-20180251426-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC (US) 2018-09-06 US disclosed
US-20160304451-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC (US) 2016-10-20 US disclosed
US-20140275063-A1 NEW ENZYME INHIBITOR COMPOUNDS PROXIMAGEN LIMITED (GB) 2014-09-18 US disclosed
US-7932271-B2 Heterocyclic methyl sulfone derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2011-04-26 US disclosed
US-20070254872-A1 Antibacterial Agents GLAXO GROUP LIMITED (GB) 2007-11-01 US disclosed
US-20060241302-A1 Morpholine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-10-26 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 (5 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-20180251426-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES BCL2, BAX, BCL3 SSTR4 4730/4885SLC6A2 4844/4885SLC6A3 4856/4885
US-20060241302-A1 Morpholine derivatives APP, BACE1, SMS SSTR4 700/4885SLC6A2 1257/4885SLC6A3 2151/4885
US-20160304451-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES BCL2, BAX, BCL3 SSTR4 4730/4885SLC6A2 4844/4885SLC6A3 4856/4885
US-20070254872-A1 Antibacterial Agents NQO2, NQO1, NDUFV2 SSTR4 4531/4885SLC6A2 2010/4885SLC6A3 3139/4885
US-20140275063-A1 NEW ENZYME INHIBITOR COMPOUNDS XDH, MAOB, MAOA SSTR4 2512/4885SLC6A2 868/4885SLC6A3 916/4885

“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.