SCHEMBL494357

SCHEMBL494357

CCCc1c(OCC(O)COc2ccc3c(=O)cc(C(=O)O)oc3c2)ccc(C(C)=O)c1O

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 11/20 0.78
CYSLTR2 Q9NS75 10/20 0.78
PDE5A O76074 3/20 0.78
MAPT P10636 2/20 0.78
MEN1 O00255 1/20 0.78
HPGD P15428 1/20 0.78
TBXAS1 P24557 1/20 0.78
KMT2A Q03164 1/20 0.78
GRM2 Q14416 2/20 0.48
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
NFKB1 P19838 1/20 0.46
PPARG P37231 1/20 0.46
BLM P54132 1/20 0.46
PPARD Q03181 1/20 0.46
PPARA Q07869 1/20 0.46
GPR35 Q9HC97 1/20 0.45

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
SCHEMBL11457218 0.88 CYSLTR2 (0.61) CYSLTR1CYSLTR2PDE5AMAPTMEN1
SCHEMBL11467865 0.88 CYSLTR1 (0.75) CYSLTR1CYSLTR2PDE5AMAPTMEN1
Fpl-55712 SCHEMBL29766724 0.88 CYSLTR2 (1.00) CYSLTR1CYSLTR2PDE5AMAPTMEN1
Fpl-55712 SCHEMBL6059336 0.88 CYSLTR2 (1.00) CYSLTR1CYSLTR2PDE5AMAPTMEN1
Fpl-55712 SCHEMBL1890292 0.87 CYSLTR2 (0.98) CYSLTR1CYSLTR2PDE5AMAPTMEN1
SCHEMBL11452135 0.85 CYSLTR2 (0.61) CYSLTR1CYSLTR2PDE5AMAPTMEN1
Fpl-55712 SCHEMBL11532832 0.84 CYSLTR2 (0.89) CYSLTR1CYSLTR2PDE5AMAPTMEN1
SCHEMBL11467868 0.84 ALDH1A1 (0.55) CYSLTR1CYSLTR2PDE5AMAPTMEN1
SCHEMBL11452109 0.83 CYSLTR1 (0.59) CYSLTR1CYSLTR2PDE5AMAPTMEN1
SCHEMBL10956354 0.83 CYSLTR2 (0.58) CYSLTR1CYSLTR2PDE5AMAPTMEN1

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-20020025969-A1 Genign prostatic hyperolasia ERFINDERGEMEINSCHAFT UROPEP GBR (DE) 2002-02-28 US claimed
US-8791124-B2 Use of phosphordiesterase inhibitors in the treatment of prostatic diseases UROPEP BIOTECH GBR (DE) 2014-07-29 US disclosed
US-8791124-B2 Use of phosphordiesterase inhibitors in the treatment of prostatic diseases UROPEP BIOTECH GBR (DE) 2014-07-29 US disclosed
US-20120172365-A1 USE OF PHOSPHORDIESTERASE INHIBITORS IN THE TREATMENT OF PROSTATIC DISEASES UROPEP BIOTECH GBR 2012-07-05 US disclosed
US-20120172365-A1 USE OF PHOSPHORDIESTERASE INHIBITORS IN THE TREATMENT OF PROSTATIC DISEASES UROPEP BIOTECH GBR 2012-07-05 US disclosed
US-8106061-B2 Use of phosphodiesterase inhibitors in the treatment of prostatic diseases UROPEP BIOTECH GBR (DE) 2012-01-31 US disclosed
US-8106061-B2 Use of phosphodiesterase inhibitors in the treatment of prostatic diseases UROPEP BIOTECH GBR (DE) 2012-01-31 US disclosed
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 disclosed
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 disclosed
US-20020025969-A1 Genign prostatic hyperolasia ERFINDERGEMEINSCHAFT UROPEP GBR (DE) 2002-02-28 US disclosed
US-20020025969-A1 Genign prostatic hyperolasia ERFINDERGEMEINSCHAFT UROPEP GBR (DE) 2002-02-28 US disclosed
WO-1999002161-A1 USE OF PHOSPHORDIESTERASE INHIBITORS IN THE TREATMENT OF PROSTATIC DISEASES FORSSMANN WOLF GEORG (DE) 1999-01-21 WO disclosed
US-4213903-A Basic amino acid salts of chromones FISONS LIMITED (GB) 1980-07-22 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 (3 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 CYSLTR1 1318/4885CYSLTR2 1695/4885PDE5A 1/4885
US-20030199517-A1 Comprises 2-(2-propoxyphenyl)-8-azapurin-6-one (zaprinast); for treatment of benign prostatic hyperplasia and urination disorders PDE12, PDE5A, QDPR CYSLTR1 949/4885CYSLTR2 1016/4885PDE5A 2/4885
US-20020025969-A1 Genign prostatic hyperolasia PDE5A, PDE3A, PDE2A CYSLTR1 1718/4885CYSLTR2 2181/4885PDE5A 1/4885

“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.