SCHEMBL1056599

SCHEMBL1056599

COc1ccccc1Nc1nc(-c2ccccc2)nc2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 9/20 1.00
MAPT P10636 7/20 1.00
MEN1 O00255 6/20 1.00
KMT2A Q03164 6/20 1.00
KDM4E B2RXH2 2/20 1.00
LMNA P02545 2/20 1.00
TDP1 Q9NUW8 2/20 1.00
L3MBTL1 Q9Y468 2/20 1.00
ALDH1A1 P00352 2/20 1.00
NPSR1 Q6W5P4 1/20 0.71
ADORA3 P0DMS8 1/20 0.70
ABCB1 P08183 1/20 0.67
ABCC1 P33527 1/20 0.67
TP53 P04637 1/20 0.65
PDE5A O76074 2/20 0.64
POLB P06746 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
SCHEMBL1084045 0.92 MAPT (0.85) ABCG2MAPTMEN1KMT2AKDM4E
SCHEMBL16404471 0.85 MAPT (0.73) ABCG2MAPTMEN1KMT2AKDM4E
SCHEMBL5101433 0.85 ABCG2 (0.74) ABCG2MAPTMEN1KMT2AKDM4E
SCHEMBL3106418 0.82 MAPT (0.69) ABCG2MAPTMEN1KMT2AKDM4E
SCHEMBL4891835 0.81 ABCG2 (0.69) ABCG2MAPTMEN1KMT2AKDM4E
SCHEMBL22273241 0.80 ABCG2 (1.00) ABCG2MAPTMEN1KMT2ALMNA
SCHEMBL1083772 0.80 MAPT (0.87) ABCG2MAPTMEN1KMT2AKDM4E
SCHEMBL2304172 0.79 KDM1A (0.65) ABCG2MAPTMEN1KMT2AKDM4E
SCHEMBL1063734 0.78 MEN1 (0.76) ABCG2MAPTMEN1KMT2AKDM4E
SCHEMBL4085200 0.78 PDE5A (1.00) ABCG2MAPTMEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080207614-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF DIABETES AND OBESITY SK CHEMICALS CO., LTD. (KR) 2008-08-28 US claimed
JP-2008526734-A 2008-07-24 JP claimed
EP-1844023-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF DIABETES AND OBESITY SK CHEMICALS CO., LTD. (KR) 2007-10-17 EP claimed
WO-2006071095-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF DIABETES AND OBESITY SK CHEMICALS CO., LTD. (KR) 2006-07-06 WO claimed
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
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-2006071095-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF DIABETES AND OBESITY SK CHEMICALS CO., LTD. (KR) 2006-07-06 WO 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 (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-20100099851-A1 SYNTHETIC HYPERGLYCOSYLATED, PROTEASE-RESISTANT POLYPEPTIDE VARIANTS, ORAL FORMULATIONS AND METHODS OF USING THE SAME IFNAR1, IDE, CTSC ABCG2 713/4885MAPT 4401/4885MEN1 3779/4885
US-20110008289-A1 HYPERGLYCOSYLATED POLYPEPTIDE VARIANTS AND METHODS OF USE IFNAR1, EPOR, HBB ABCG2 439/4885MAPT 4432/4885MEN1 3843/4885
US-20060182716-A1 Synthetic hyperglycosylated, protease-resistant polypeptide variants, oral formulations and methods of using the same IFNAR1, IDE, CTSC ABCG2 713/4885MAPT 4401/4885MEN1 3779/4885
US-20080207614-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF DIABETES AND OBESITY GPR119, GCKR, GLP1R ABCG2 207/4885MAPT 4050/4885MEN1 3837/4885
US-20060204473-A1 Synthetic hyperglycosylated, and hyperglycosylated protease-resistant polypeptide variants, oral formulations and methods of using the same IFNAR1, EPOR, HBB ABCG2 336/4885MAPT 4382/4885MEN1 3792/4885

“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.