SCHEMBL149748

SCHEMBL149748

O=C(O)C1CCN(c2nc(NCc3ccc4c(c3)OCO4)c3cc(Cl)ccc3n2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 1.00
PDE4B Q07343 2/20 1.00
PDE4C Q08493 2/20 1.00
PDE4D Q08499 2/20 1.00
PDE5A O76074 5/20 0.86
PDE2A O00408 1/20 0.86
PDE1A P54750 1/20 0.86
PDE1B Q01064 1/20 0.86
PDE1C Q14123 1/20 0.86
MEN1 O00255 1/20 0.56
ALDH1A1 P00352 1/20 0.56
KMT2A Q03164 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
HRH4 Q9H3N8 10/20 0.54
HTR3A P46098 3/20 0.52
KDM4E B2RXH2 2/20 0.51
HRH1 P35367 2/20 0.51
RXFP1 Q9HBX9 1/20 0.49
CTNNB1 P35222 2/20 0.47
TCF7L2 Q9NQB0 2/20 0.47

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
Hydrochloric Acid SCHEMBL29801523 0.99 PDE4A (0.98) PDE4APDE4BPDE4CPDE4DPDE5A
Potassium SCHEMBL7504150 0.99 PDE4A (0.98) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL5917668 0.99 PDE4A (0.98) PDE4APDE4BPDE4CPDE4DPDE5A
Hydrochloric Acid SCHEMBL7502602 0.99 PDE4A (0.98) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL7504141 0.99 PDE4A (0.98) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL5917665 0.99 PDE4A (0.98) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL7502434 0.96 PDE4A (0.92) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL7500079 0.93 PDE4A (0.87) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL2232142 0.92 PDE5A (1.00) PDE4APDE4BPDE4CPDE4DPDE5A
Potassium Ion SCHEMBL7504145 0.92 PDE5A (0.97) PDE4APDE4BPDE4CPDE4DPDE5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150320739-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II BAUSCH HEALTH IRELAND LIMITED (F/K/A/ VALEANT PHARMACEUTICALS IRELAND LIMITED) (IE) 2015-11-12 US claimed
US-20130203766-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II SPROUT PHARMACEUTICALS, INC. (US) 2013-08-08 US claimed
US-8217049-B2 Use of type V phosphodiesterase inhibitors in the treatment of exercise induced pulmonary hemorrhage in the equine ANOXA CORP. (US) 2012-07-10 US claimed
US-20110105519-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II SPROUT PHARMACEUTICALS, INC. 2011-05-05 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
EP-2051759-A1 USE OF TYPE V PHOSPHODIESTERASE INHIBITORS IN THE TREATMENT OF EXERCISE INDUCED PULMONARY HEMORRHAGE IN THE EQUINE Perry, Bryan J. (US) 2009-04-29 EP claimed
US-20080103155-A1 Pharmaceutical compositions for the treatment of sexual disorders II SPROUT PHARMACEUTICALS, INC. 2008-05-01 US claimed
EP-1858554-A2 NEW PHARMACEUTICAL COMPOSITIONS BASED ON ANTICHOLINERGICS AND PDE 5-INHIBITORS Boehringer Ingelheim International GmbH (DE) 2007-11-28 EP claimed
WO-2007130427-A1 USE OF TYPE V PHOSPHODIESTERASE INHIBITORS IN THE TREATMENT OF EXERCISE INDUCED PULMONARY HEMORRHAGE IN THE EQUINE PERRY BRYAN J (US) 2007-11-15 WO claimed
EP-1120120-A1 TABLETS IMMEDIATELY DISINTEGRATING IN THE ORAL CAVITY Eisai Co., Ltd. (JP) 2001-08-01 EP claimed
WO-2001041807-A2 TRANSMUCOSAL COMPOSITION CONTAINING A PHOSPHODIESTERASE INHIBITORS FOR THE TREATMENT OF ERECTILE DYSFUNCTION VIVUS, INC. (US) 2001-06-14 WO claimed
EP-1027054-A1 LOCAL ADMINISTRATION OF PHOSPHODIESTERASE INHIBITORS FOR THE TREATMENT OF ERECTILE DYSFUNCTION Vivus, Inc. (US) 2000-08-16 EP claimed
US-6037346-A Local administration of phosphodiesterase inhibitors for the treatment of erectile dysfunction VIVUS, INC. (US) 2000-03-14 US claimed
WO-1999021558-A2 LOCAL ADMINISTRATION OF PHOSPHODIESTERASE INHIBITORS FOR THE TREATMENT OF ERECTILE DYSFUNCTION VIVUS, INC. (US) 1999-05-06 WO claimed
US-5765548-A Use of nitric oxide in the treatment of exercised induced pulmonary hemorrhaging in equine ANOXA CORP. 1998-06-16 US claimed
WO-1997041912-A1 USE OF NITRIC OXIDE IN THE TREATMENT OF EXERCISED INDUCED PULMONARY HEMORRHAGING IN EQUINE PERRY BRYAN J (US) 1997-11-13 WO claimed
EP-0793486-A1 cGMP-PDE INHIBITORS FOR THE TREATMENT OF ERECTILE DYSFUNCTION Pfizer Limited (GB) 1997-09-10 EP claimed
US-5576322-A Anti-ischemic 2,4-diaminoquinazolines EISAI CO., LTD. (JP) 1996-11-19 US 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 (4 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-20080103155-A1 Pharmaceutical compositions for the treatment of sexual disorders II FLNB, FLNA, FGB PDE4A 118/4885PDE4B 49/4885PDE4C 111/4885
US-20130203766-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II FLNB, FLNA, FGB PDE4A 118/4885PDE4B 49/4885PDE4C 111/4885
US-20110105519-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II FLNB, FLNA, FGB PDE4A 118/4885PDE4B 49/4885PDE4C 111/4885
US-20150320739-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II FLNB, FLNA, FGB PDE4A 118/4885PDE4B 49/4885PDE4C 111/4885

“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.