SCHEMBL147829

SCHEMBL147829

Cc1nn(C2CCCC2)c2nc(-c3ccncc3)[nH]c(=O)c12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 3/20 0.56
GRIA2 P42262 3/20 0.56
GRIA3 P42263 3/20 0.56
GRIA4 P48058 3/20 0.56
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 3/20 0.46
HSD17B10 Q99714 3/20 0.46
KMT2A Q03164 1/20 0.41
PDE7A Q13946 1/20 0.39
PDE7B Q9NP56 1/20 0.39
CFTR P13569 1/20 0.39
PDE5A O76074 2/20 0.39
HPGD P15428 2/20 0.38
PDE9A O76083 2/20 0.38
MAPT P10636 1/20 0.38
ALOX15 P16050 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
PDE1A P54750 1/20 0.37
PDE1B Q01064 1/20 0.37
PDE1C Q14123 1/20 0.37

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
SCHEMBL7316083 0.72 KDM4E (0.46) ALDH1A1KDM4EHSD17B10CFTRHPGD
SCHEMBL13865774 0.70 ALDH1A1 (0.46) ALDH1A1KDM4EHSD17B10PDE7APDE7B
SCHEMBL5232135 0.70 PDE7A (0.60) PDE7APDE7BPDE5AHPGD
SCHEMBL13865846 0.68 KHK (0.48) ALDH1A1KDM4EHSD17B10CFTRHPGD
SCHEMBL5232549 0.68 PDE7A (0.69) PDE7APDE7BHPGD
SCHEMBL13865755 0.68 ALDH1A1 (0.44) ALDH1A1KDM4EHSD17B10PDE7ACFTR
Hydrochloric Acid SCHEMBL4511529 0.68 KHK (0.46) ALDH1A1KDM4EHSD17B10PDE7A
SCHEMBL13870387 0.67 KHK (0.48) ALDH1A1KDM4EHSD17B10KMT2ACFTR
SCHEMBL13865763 0.67 ALDH1A1 (0.43) ALDH1A1KDM4EHSD17B10CFTRPDE5A
SCHEMBL31194502 0.66 ALDH1A1 (0.40) ALDH1A1KDM4EHSD17B10PDE7APDE7B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160206623-A9 Composition For Prevention of Vasoactivity in the Treatment of Blood Loss and Anemia BLUMENSTEIN JAN (CA) 2016-07-21 US claimed
US-20150290213-A1 Composition For Prevention of Vasoactivity in the Treatment of Blood Loss and Anemia BLUMENSTEIN JAN (CA) 2015-10-15 US claimed
US-8791124-B2 Use of phosphordiesterase inhibitors in the treatment of prostatic diseases UROPEP BIOTECH GBR (DE) 2014-07-29 US claimed
US-20130274245-A1 Composition For Prevention of Vasoactivity in the Treatment of Blood Loss and Anemia BLUMENSTEIN JAN (CA) 2013-10-17 US claimed
US-20120172365-A1 USE OF PHOSPHORDIESTERASE INHIBITORS IN THE TREATMENT OF PROSTATIC DISEASES UROPEP BIOTECH GBR 2012-07-05 US claimed
US-8106061-B2 Use of phosphodiesterase inhibitors in the treatment of prostatic diseases UROPEP BIOTECH GBR (DE) 2012-01-31 US claimed
US-20100179152-A1 Novel use for PDE5 inhibitors NYCOMED GMBH (DE) 2010-07-15 US claimed
EP-1740183-B1 NOVEL USE FOR PDE5 INHIBITORS NYCOMED GMBH (DE) 2009-10-14 EP claimed
US-20070185114-A1 Novel use for pde5 inhibitors ALTANA PHARMA AG (DE) 2007-08-09 US claimed
US-20050107394-A1 for the treatment of respiratory failure in patients showing a mismatch of pulmonary ventilation and pulmonary perfusion; e.g. 3-ethyl-8-[2-(4-morpholinylmethyl)benzylamino]-2,3-dihydro-1H-imidazo[4,5-g]quinazoline-2-thione GHOFRANI ARDESCHIR (DE) 2005-05-19 US claimed
EP-1461022-A2 USE OF SELECTIVE PDE5 INHIBITORS FOR TREATING PARTIAL AND GLOBAL RESPIRATORY FAILURE ALTANA Pharma AG (DE) 2004-09-29 EP claimed
EP-0754069-B1 TREATMENT OF PULMONARY VASOCONSTRICTION AND ASTHMA GEN HOSPITAL CORP (US) 2004-06-23 EP claimed
US-20040087599-A1 cGMP-PDE inhibitors for the treatment of erectile dysfunction PFIZER INC 2004-05-06 US claimed
US-20030199517-A1 Comprises 2-(2-propoxyphenyl)-8-azapurin-6-one (zaprinast); for treatment of benign prostatic hyperplasia and urination disorders WOLF-GEORG FORSSMANN 2003-10-23 US claimed
WO-2003051346-A2 USE OF SELECTIVE PDE5 INHIBITORS FOR TREATING PARTIAL AND GLOBAL RESPIRATORY FAILURE ALTANA PHARMA AG (DE) 2003-06-26 WO claimed
US-6469016-B1 VAGINAL, VULVAR AND/OR URETHRAL ADMINISTRATION OF A PHARMACEUTICAL FORMULATION CONTAINING A VASOACTIVE AGENT TO INCREASE VAGINAL LUBRICATION VIVUS, INC. 2002-10-22 US claimed
US-20020025969-A1 Genign prostatic hyperolasia ERFINDERGEMEINSCHAFT UROPEP GBR (DE) 2002-02-28 US claimed
US-20010044441-A1 6-heterocyclyl pyrazolo [3,4-d]pyrimidin-4-one cGMP-PDE inhibitors for the treatment of erectile dysfunction CAMPBELL SIMON FRASER (GB) 2001-11-22 US claimed
EP-0793486-A1 cGMP-PDE INHIBITORS FOR THE TREATMENT OF ERECTILE DYSFUNCTION Pfizer Limited (GB) 1997-09-10 EP claimed
WO-1996016644-A1 cGMP-PDE INHIBITORS FOR THE TREATMENT OF ERECTILE DYSFUNCTION PFIZER LIMITED (GB) 1996-06-06 WO claimed

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-20120172365-A1 USE OF PHOSPHORDIESTERASE INHIBITORS IN THE TREATMENT OF PROSTATIC DISEASES PDE5A, PDE7A, PDE12 GRIA1 2573/4885GRIA2 3790/4885GRIA3 3981/4885
US-20040087599-A1 cGMP-PDE inhibitors for the treatment of erectile dysfunction PDE3A, PDE5A, PDE2A GRIA1 1631/4885GRIA2 2376/4885GRIA3 1670/4885
US-20010044441-A1 6-heterocyclyl pyrazolo [3,4-d]pyrimidin-4-one cGMP-PDE inhibitors for the treatment of erectile dysfunction PDE3A, PDE2A, PDE3B GRIA1 2591/4885GRIA2 3675/4885GRIA3 2629/4885
US-20030199517-A1 Comprises 2-(2-propoxyphenyl)-8-azapurin-6-one (zaprinast); for treatment of benign prostatic hyperplasia and urination disorders PDE12, PDE5A, QDPR GRIA1 3265/4885GRIA2 3995/4885GRIA3 4394/4885
US-20020025969-A1 Genign prostatic hyperolasia PDE5A, PDE3A, PDE2A GRIA1 657/4885GRIA2 1377/4885GRIA3 1169/4885

“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.