SCHEMBL1063009

SCHEMBL1063009

c1ccc(-c2nc(Nc3ncccn3)c3ccccc3n2)cc1

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 9/20 0.69
MEN1 O00255 2/20 0.69
KMT2A Q03164 2/20 0.69
PDE5A O76074 8/20 0.67
TGFBR1 P36897 1/20 0.66
MAPK14 Q16539 1/20 0.66
GSK3A P49840 3/20 0.62
GSK3B P49841 3/20 0.62
KDM4E B2RXH2 1/20 0.61
ALDH1A1 P00352 1/20 0.61
POLB P06746 1/20 0.61
HPGD P15428 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
LMNA P02545 1/20 0.60
TP53 P04637 1/20 0.60
MAPT P10636 1/20 0.60
GAA P10253 1/20 0.60

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
SCHEMBL1062754 0.84 ABCG2 (0.65) ABCG2MEN1KMT2APDE5ATGFBR1
SCHEMBL1063103 0.81 ABCG2 (1.00) ABCG2MEN1KMT2APDE5ATGFBR1
SCHEMBL412953 0.79 TGFBR1 (1.00) ABCG2MEN1KMT2APDE5ATGFBR1
SCHEMBL31061048 0.79 TGFBR1 (1.00) ABCG2MEN1KMT2APDE5ATGFBR1
SCHEMBL5252846 0.78 GSK3A (0.61) ABCG2MEN1KMT2APDE5ATGFBR1
SCHEMBL1062987 0.78 TGFBR1 (0.68) ABCG2MEN1KMT2APDE5ATGFBR1
SCHEMBL4868573 0.77 ABCG2 (1.00) ABCG2MEN1KMT2APDE5ATGFBR1
SCHEMBL15233162 0.77 GSK3B (1.00) ABCG2MEN1KMT2APDE5ATGFBR1
SCHEMBL802580 0.77 GSK3B (0.56) ABCG2MEN1KMT2APDE5ATGFBR1
SCHEMBL7434986 0.76 ALDH1A1 (1.00) ABCG2MEN1KMT2APDE5ATGFBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8343980-B2 Quinazoles useful as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-01-01 US disclosed
US-8343980-B2 Quinazoles useful as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-01-01 US disclosed
US-8153642-B2 Quinazolines useful as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-04-10 US disclosed
US-8153642-B2 Quinazolines useful as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-04-10 US disclosed
US-20110008289-A1 HYPERGLYCOSYLATED POLYPEPTIDE VARIANTS AND METHODS OF USE ALIOS BIOPHARMA, INC. (US) 2011-01-13 US disclosed
US-7713983-B2 Quinazolines useful as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-05-11 US disclosed
US-7713983-B2 Quinazolines useful as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-05-11 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-7678802-B2 Quinazolines useful as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-03-16 US disclosed
US-7678802-B2 Quinazolines useful as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-03-16 US 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
WO-2007092537-A2 SYNTHETIC HYPERGLYCOSYLATED, AND HYPERGLYCOSYLATED PROTEASE-RESISTANT POLYPEPTIDE VARIANTS, ORAL FORMULATIONS AND METHODS OF USING THE SAME ALIOS BIOPHARMA, INC. (US) 2007-08-16 WO disclosed
EP-1789074-A2 SYNTHETIC HYPERGLYCOSYLATED, PROTEASE-RESISTANT POLYPEPTIDE VARIANTS, ORAL FORMULATIONS AND METHODS OF USING THE SAME Alios Biopharma Inc. (US) 2007-05-30 EP disclosed
US-20060204473-A1 Synthetic hyperglycosylated, and hyperglycosylated protease-resistant polypeptide variants, oral formulations and methods of using the same ALIOS BIOPHARMA, INC. 2006-09-14 US disclosed
US-20060182716-A1 Synthetic hyperglycosylated, protease-resistant polypeptide variants, oral formulations and methods of using the same ALIOS BIOPHARMA, INC. 2006-08-17 US 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
WO-2004105684-A2 COMBINATION THERAPY FOR PROLIFERATIVE DISORDERS INTERMUNE, INC. (US) 2004-12-09 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 (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 ABCG2 713/4885MEN1 3779/4885KMT2A 4519/4885
US-20110008289-A1 HYPERGLYCOSYLATED POLYPEPTIDE VARIANTS AND METHODS OF USE IFNAR1, EPOR, HBB ABCG2 439/4885MEN1 3843/4885KMT2A 4668/4885
US-20060182716-A1 Synthetic hyperglycosylated, protease-resistant polypeptide variants, oral formulations and methods of using the same IFNAR1, IDE, CTSC ABCG2 713/4885MEN1 3779/4885KMT2A 4519/4885
US-20060204473-A1 Synthetic hyperglycosylated, and hyperglycosylated protease-resistant polypeptide variants, oral formulations and methods of using the same IFNAR1, EPOR, HBB ABCG2 336/4885MEN1 3792/4885KMT2A 4560/4885

“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.