SCHEMBL1062608

SCHEMBL1062608

c1ccc(-c2nc(NCc3ccccn3)c3ccccc3n2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 9/20 1.00
GBA1 P04062 3/20 0.70
MAPT P10636 2/20 0.70
ALDH1A1 P00352 2/20 0.70
KDM4E B2RXH2 1/20 0.70
MEN1 O00255 4/20 0.68
KMT2A Q03164 4/20 0.68
ATM Q13315 1/20 0.68
LMNA P02545 2/20 0.67
TSHR P16473 1/20 0.67
HTT P42858 1/20 0.67
PIP4K2C Q8TBX8 1/20 0.67
KCNA5 P22460 3/20 0.65
KCNH2 Q12809 3/20 0.65
PTGS1 P23219 1/20 0.61
TBXAS1 P24557 1/20 0.61
PTGS2 P35354 1/20 0.61
CYP1A2 P05177 1/20 0.61
POLB P06746 1/20 0.61
CYP3A4 P08684 1/20 0.61

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
SCHEMBL1064493 0.86 GBA1 (0.82) PDE5AGBA1ALDH1A1KDM4EMEN1
SCHEMBL12170050 0.83 KCNA5 (0.91) PDE5AKCNA5KCNH2JAK2LCK
SCHEMBL17212407 0.82 PDE5A (0.68) PDE5AGBA1MAPTALDH1A1KDM4E
SCHEMBL4089465 0.82 PDE5A (0.69) PDE5AGBA1MAPTALDH1A1KDM4E
SCHEMBL1083763 0.81 PDE5A (1.00) PDE5AGBA1MAPTALDH1A1MEN1
SCHEMBL22201478 0.81 GBA1 (0.77) PDE5AGBA1MAPTALDH1A1KDM4E
SCHEMBL16183717 0.80 PDE5A (0.66) PDE5AGBA1MAPTALDH1A1KDM4E
SCHEMBL12170017 0.80 KCNA5 (1.00) KCNA5KCNH2JAK2LCKLYN
SCHEMBL1062736 0.79 PDE5A (0.89) PDE5AGBA1MAPTALDH1A1KDM4E
SCHEMBL16183255 0.79 PDE5A (0.65) PDE5AGBA1MAPTALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102753535-B Quinazolines as Potassium Channel Inhibitors BRISTOL MYERS SQUIBB CO 2015-03-25 CN disclosed
US-20110008289-A1 HYPERGLYCOSYLATED POLYPEPTIDE VARIANTS AND METHODS OF USE ALIOS BIOPHARMA, INC. (US) 2011-01-13 US disclosed
US-20100099851-A1 SYNTHETIC HYPERGLYCOSYLATED, PROTEASE-RESISTANT POLYPEPTIDE VARIANTS, ORAL FORMULATIONS AND METHODS OF USING THE SAME ALIOS BIOPHARMA, INC. (US) 2010-04-22 US disclosed
US-7597884-B2 Hyperglycosylated polypeptide variants and methods of use ALIOS BIOPHARMA, INC. (US) 2009-10-06 US disclosed
EP-2093235-A1 Hyperglycosylated variants of interferon alfacon-1 Alios Biopharma Inc. (US) 2009-08-26 EP disclosed
EP-1789074-A4 SYNTHETIC HYPERGLYCOSYLATED, PROTEASE-RESISTANT POLYPEPTIDE VARIANTS, ORAL FORMULATIONS AND METHODS OF USING THE SAME ALIOS BIOPHARMA INC (US) 2009-08-12 EP disclosed
EP-1987060-A2 SYNTHETIC HYPERGLYCOSYLATED, AND HYPERGLYCOSYLATED PROTEASE-RESISTANT POLYPEPTIDE VARIANTS, ORAL FORMULATIONS AND METHODS OF USING THE SAME Alios Biopharma Inc. (US) 2008-11-05 EP disclosed
US-7345045-B2 Pyrido-pyrimidine compounds as medicaments SCIOS, INC. (US) 2008-03-18 US disclosed
US-7345045-B2 Pyrido-pyrimidine compounds as medicaments SCIOS, INC. (US) 2008-03-18 US disclosed
CN-101102787-A Synthetic hyperglycosylated, and hyperglycosylated protease-resistant polypeptide variants, oral formulations and methods of using the same ALIOS BIOPHARMA INC (US) 2008-01-09 CN disclosed
WO-2006020580-A2 SYNTHETIC HYPERGLYCOSYLATED, PROTEASE-RESISTANT POLYPEPTIDE VARIANTS, ORAL FORMULATIONS AND METHODS OF USING THE SAME ALIOS BIOPHARMA INC. (US) 2006-02-23 WO disclosed
WO-2005110455-A2 COMBINATION THERAPY FOR TREATING HEPATITIS VIRUS INFECTION INTERMUNE, INC. (US) 2005-11-24 WO disclosed
US-20050220784-A1 Quinazoline derivatives as medicaments SCIOS, INC. (US) 2005-10-06 US disclosed
US-20050171123-A1 Quinazoline derivatives as medicaments SCIOS, INC. 2005-08-04 US disclosed
WO-2004105684-A2 COMBINATION THERAPY FOR PROLIFERATIVE DISORDERS INTERMUNE, INC. (US) 2004-12-09 WO disclosed
CN-1152867-C Quinazoline derivatives as medicaments �����ɷ� 2004-06-09 CN disclosed
US-6476031-B1 Quinazoline derivatives as medicaments SCIOS, INC. 2002-11-05 US disclosed
CN-1333757-A Quinazoline derivatives as medicaments SCIOS INC (US) 2002-01-30 CN disclosed
US-6277989-B1 USEFUL IN TREATING CONDITIONS THAT ARE CHARACTERIZED BY ENHANCED P38 KINASE ACTIVITY AND/OR TRANSFORMING GROWTH FACTOR BETA (TGF-.BETA.) ACTIVITY SUCH AS INFLAMMATION, PROLIFERATIVE DISEASES, AND CERTAIN CARDIOVASCULAR DISORDERS SCIOS, INC. 2001-08-21 US disclosed
US-6184226-B1 ANTIINFLAMMATORY AGENTS FOR TREATMENT OF CARDIOVASCULAR SYSTEM DISORDERS/RESPIRATORY SYSTEM DISORDERS, ANTIISCHEMIC AGENTS SCIOS INC. 2001-02-06 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 (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-20100099851-A1 SYNTHETIC HYPERGLYCOSYLATED, PROTEASE-RESISTANT POLYPEPTIDE VARIANTS, ORAL FORMULATIONS AND METHODS OF USING THE SAME IFNAR1, IDE, CTSC PDE5A 1222/4885GBA1 96/4885MAPT 4401/4885
US-20110008289-A1 HYPERGLYCOSYLATED POLYPEPTIDE VARIANTS AND METHODS OF USE IFNAR1, EPOR, HBB PDE5A 1701/4885GBA1 122/4885MAPT 4432/4885
US-20050171123-A1 Quinazoline derivatives as medicaments TGFBR2, SMAD2, ADRB2 PDE5A 1211/4885GBA1 2263/4885MAPT 4024/4885
US-20050220784-A1 Quinazoline derivatives as medicaments TGFBR2, SMAD2, ADRB2 PDE5A 1211/4885GBA1 2263/4885MAPT 4024/4885

“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.