SCHEMBL10145343

SCHEMBL10145343

CN[C@@H]1CCCC[C@H]1CO

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PABPC1 P11940 1/20 0.38
APOBEC3A P31941 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CNR2 P34972 1/20 0.35
CNR1 P21554 2/20 0.34
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
LTA4H P09960 2/20 0.32
S1PR1 P21453 1/20 0.31
S1PR3 Q99500 1/20 0.31
OPRK1 P41145 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
SCHEMBL16378039 1.00 PABPC1 (0.38) PABPC1APOBEC3AAPOBEC3GTDP1CNR2
SCHEMBL14368919 1.00 PABPC1 (0.38) PABPC1APOBEC3AAPOBEC3GTDP1CNR2
SCHEMBL12797461 1.00 PABPC1 (0.38) PABPC1APOBEC3AAPOBEC3GTDP1CNR2
SCHEMBL17336290 1.00 PABPC1 (0.38) PABPC1APOBEC3AAPOBEC3GTDP1CNR2
SCHEMBL765702 0.95
SCHEMBL14896098 0.95
SCHEMBL25784693 0.95
SCHEMBL14893446 0.95
SCHEMBL12954033 0.95
Alcohol SCHEMBL14108707 0.91 JAK2 (0.34) PABPC1APOBEC3AAPOBEC3GTDP1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9662339-B2 Benzodioxane inhibitors of leukotriene production for combination therapy BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2017-05-30 US disclosed
US-9662339-B2 Benzodioxane inhibitors of leukotriene production for combination therapy BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2017-05-30 US disclosed
US-9133146-B2 Benzodioxane inhibitors of leukotriene production BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-09-15 US disclosed
US-9133146-B2 Benzodioxane inhibitors of leukotriene production BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-09-15 US disclosed
US-9079897-B2 Imidazo-pyridine derivatives as activin-like receptor kinase (ALK4 or ALK5) inhibitors NOVARTIS AG (CH) 2015-07-14 US disclosed
US-9079897-B2 Imidazo-pyridine derivatives as activin-like receptor kinase (ALK4 or ALK5) inhibitors NOVARTIS AG (CH) 2015-07-14 US disclosed
US-8946203-B2 Benzodioxane inhibitors of leukotriene production BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-02-03 US disclosed
US-8946203-B2 Benzodioxane inhibitors of leukotriene production BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-02-03 US disclosed
US-20130310373-A1 PYRIMIDINE COMPOUND ASTELLAS PHARMA INC. (JP) 2013-11-21 US disclosed
US-8551982-B2 Benzodioxane inhibitors of leukotriene production BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-10-08 US disclosed
EP-2415765-A1 PYRIMIDINE COMPOUND Astellas Pharma Inc. (JP) 2012-02-08 EP disclosed
US-20110060004-A1 Imidazo-Pyridine Derivatives as Activin-Like Receptor Kinase (ALK4 or ALK5) Inhibitors NOVARTIS AG (CH) 2011-03-10 US disclosed
US-20110060004-A1 Imidazo-Pyridine Derivatives as Activin-Like Receptor Kinase (ALK4 or ALK5) Inhibitors NOVARTIS AG (CH) 2011-03-10 US disclosed
US-20110053912-A1 PYRIMIDINE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-03-03 US disclosed
US-20110053912-A1 PYRIMIDINE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-03-03 US disclosed
US-20110046108-A1 PYRIMIDINE DERIVATIVES ASTRAZENECA AB (SE) 2011-02-24 US disclosed
WO-2010113834-A1 PYRIMIDINE COMPOUND アステラス製薬株式会社 (JP) 2010-10-07 WO disclosed
WO-2009133070-A1 IMIDAZO-PYRIDINE DERIVATIVES AS ACTIVIN-LIKE RECEPTOR KINASE (ALK4 OR ALK5) INHIBITORS NOVARTIS AG (CH) 2009-11-05 WO disclosed
US-20070259888-A1 Novel Compounds ASTRAZENECA AB (SE) 2007-11-08 US disclosed
WO-2007085833-A2 PYRIMIDINE DERIVATIVES ASTRAZENECA AB (SE) 2007-08-02 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 (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-20070259888-A1 Novel Compounds OPRL1, OPRM1, SIGMAR1 PABPC1 1380/4885APOBEC3A 4474/4885APOBEC3G 4595/4885
US-20110060004-A1 Imidazo-Pyridine Derivatives as Activin-Like Receptor Kinase (ALK4 or ALK5) Inhibitors ACVR1, ALK, ACVRL1 PABPC1 4662/4885APOBEC3A 4306/4885APOBEC3G 4415/4885
US-20110053912-A1 PYRIMIDINE COMPOUND CNR2, CNR1, P2RY2 PABPC1 2176/4885APOBEC3A 2325/4885APOBEC3G 2194/4885
US-20130310373-A1 PYRIMIDINE COMPOUND CNR2, CNR1, P2RY2 PABPC1 3037/4885APOBEC3A 2118/4885APOBEC3G 1807/4885
US-20110046108-A1 PYRIMIDINE DERIVATIVES EPHB4, EPHB1, EPHB3 PABPC1 2079/4885APOBEC3A 964/4885APOBEC3G 1621/4885

“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.