SCHEMBL2484100

SCHEMBL2484100

CN1CCc2c(N)cccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 2/20 0.44
KEAP1 Q14145 1/20 0.38
SLC6A2 P23975 3/20 0.38
SLC6A4 P31645 3/20 0.38
SLC6A3 Q01959 3/20 0.38
CYP2D6 P10635 2/20 0.38
ADRA1A P35348 2/20 0.38
CYP3A4 P08684 2/20 0.38
RGS12 O14924 1/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
ALOX12 P18054 1/20 0.38
NFKB1 P19838 1/20 0.38
HTR2A P28223 1/20 0.38
MAPK1 P28482 1/20 0.38
PTGS2 P35354 1/20 0.38
HRH1 P35367 1/20 0.38
OPRM1 P35372 1/20 0.38
GNAI1 P63096 1/20 0.38
KCNH2 Q12809 1/20 0.38

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
SCHEMBL6402604 0.89 TNKS (0.43) ADRA2CKEAP1SLC6A2SLC6A4SLC6A3
SCHEMBL13068325 0.78 KEAP1 (0.39) ADRA2CKEAP1SLC6A2SLC6A4SLC6A3
SCHEMBL13462411 0.78 S1PR1 (0.37) ADRA2CCYP2D6ADRA1AGAAMGLL
SCHEMBL256749 0.78 NOTUM (0.56) SLC6A2SLC6A4SLC6A3GAAKDM4E
SCHEMBL18373752 0.76 KEAP1 (0.38) ADRA2CKEAP1SLC6A2SLC6A4SLC6A3
SCHEMBL25044260 0.76 KDM4E (0.35) ADRA2CCYP2D6ADRA1AGAAMGLL
SCHEMBL2625776 0.76 NOTUM (0.57) ADRA2CCYP2D6ADRA1AGAAKDM4E
SCHEMBL94532 0.76 DRD2 (0.46) SLC6A2SLC6A4SLC6A3MGLLNOTUM
SCHEMBL2625772 0.76 NOTUM (0.57) ADRA2CCYP2D6ADRA1AHTR2AADRA2A
SCHEMBL21605177 0.76 NOTUM (0.33) ADRA2CCYP2D6ADRA1AGAAMGLL

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11795192-B2 Antimicrobial compounds, compositions, and uses thereof Lakewood Amedex, Inc. (US) 2023-10-24 US disclosed
EP-4104861-A1 THERAPEUTIC AGENT FOR TAUOPATHIES Sumitomo Pharma Co., Ltd. (JP) 2022-12-21 EP disclosed
EP-2225236-B1 ORGANIC COMPOUNDS BOEHRINGER INGELHEIM INT (DE) 2016-01-27 EP disclosed
US-8829006-B2 Compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-09-09 US disclosed
EP-1944305-B1 Quinoline derivatives as phosphodiesterase inhibitors GLAXO GROUP LTD (GB) 2011-10-19 EP disclosed
EP-1944305-B1 Quinoline derivatives as phosphodiesterase inhibitors GLAXO GROUP LTD (GB) 2011-10-19 EP disclosed
US-20110195954-A1 NOVEL COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-08-11 US disclosed
CN-1823063-B Quinoline derivatives as phosphodiesterase inhibitors GLAXO GROUP LTD 2010-07-14 CN disclosed
US-20090312325-A1 Quinoline Derivatives As Phosphodiesterase Inhibitors BALDWIN IAN ROBERT 2009-12-17 US disclosed
US-20090312325-A1 Quinoline Derivatives As Phosphodiesterase Inhibitors BALDWIN IAN ROBERT 2009-12-17 US disclosed
EP-1633748-B1 QUINOLINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LTD (GB) 2008-03-05 EP disclosed
US-20070142373-A1 Quinoline derivatives as phosphodiesterase inhibitors GLAXO GROUP LIMITED (GB) 2007-06-21 US disclosed
US-20070142373-A1 Quinoline derivatives as phosphodiesterase inhibitors GLAXO GROUP LIMITED (GB) 2007-06-21 US disclosed
US-20070142373-A1 Quinoline derivatives as phosphodiesterase inhibitors GLAXO GROUP LIMITED (GB) 2007-06-21 US disclosed
US-20070049570-A1 Quinoline derivatives as phosphodiesterase inhibitors DEAN ANTHONY W 2007-03-01 US disclosed
US-20070049570-A1 Quinoline derivatives as phosphodiesterase inhibitors DEAN ANTHONY W 2007-03-01 US disclosed
US-20070049570-A1 Quinoline derivatives as phosphodiesterase inhibitors DEAN ANTHONY W 2007-03-01 US disclosed
CN-1823063-A Quinoline derivatives as phosphodiesterase inhibitors GLAXO GROUP LTD (GB) 2006-08-23 CN disclosed
US-20060178416-A1 Quinoline derivatives as phosphodiesterase inhibitors BARKER MICHAEL D 2006-08-10 US disclosed
WO-2004103998-A1 QUINOLINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LIMITED (GB) 2004-12-02 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 (6 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-20060178416-A1 Quinoline derivatives as phosphodiesterase inhibitors PDE3B, PDE4B, PDE4A ADRA2C 65/4885KEAP1 2970/4885SLC6A2 1461/4885
US-20110195954-A1 NOVEL COMPOUNDS CALCRL, CALCR, CALCA ADRA2C 158/4885KEAP1 2912/4885SLC6A2 445/4885
US-20090312325-A1 Quinoline Derivatives As Phosphodiesterase Inhibitors PDE3B, PDE4B, PDE4A ADRA2C 65/4885KEAP1 2970/4885SLC6A2 1461/4885
US-20070049570-A1 Quinoline derivatives as phosphodiesterase inhibitors PDE3B, PDE4B, PDE4A ADRA2C 65/4885KEAP1 2970/4885SLC6A2 1461/4885
US-11795192-B2 Antimicrobial compounds, compositions, and uses thereof CAT, MPO, NISCH ADRA2C 4230/4885KEAP1 2328/4885SLC6A2 4049/4885
US-20070142373-A1 Quinoline derivatives as phosphodiesterase inhibitors PDE3B, PDE4B, PDE4A ADRA2C 65/4885KEAP1 2970/4885SLC6A2 1461/4885

“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.