SCHEMBL413202

SCHEMBL413202

Fc1ccc(-c2nc(Nc3ccncc3)c3ccccc3n2)cc1

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 1/20 0.86
MAPK14 Q16539 1/20 0.86
HPGD P15428 6/20 0.81
KDM4E B2RXH2 5/20 0.81
ALDH1A1 P00352 3/20 0.81
SMN1; SMN2 Q16637 3/20 0.81
POLB P06746 2/20 0.81
PDE5A O76074 2/20 0.81
ABCG2 Q9UNQ0 6/20 0.78
LMNA P02545 5/20 0.74
MAPT P10636 4/20 0.74
CYP1A2 P05177 4/20 0.74
CYP3A4 P08684 4/20 0.74
CYP2C19 P33261 4/20 0.74
MEN1 O00255 4/20 0.74
KMT2A Q03164 4/20 0.74
MAPK1 P28482 3/20 0.74
TDP1 Q9NUW8 3/20 0.74
TSHR P16473 2/20 0.74
CYP2D6 P10635 2/20 0.74

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
SCHEMBL22201578 0.94 HPGD (0.86) TGFBR1MAPK14HPGDKDM4EALDH1A1
SCHEMBL31061048 0.93 TGFBR1 (1.00) TGFBR1MAPK14HPGDKDM4EALDH1A1
SCHEMBL14262837 0.93 KDM4E (0.94) TGFBR1MAPK14HPGDKDM4EALDH1A1
SCHEMBL412953 0.93 TGFBR1 (1.00) TGFBR1MAPK14HPGDKDM4EALDH1A1
SCHEMBL7434986 0.90 ALDH1A1 (1.00) TGFBR1MAPK14HPGDKDM4EALDH1A1
SCHEMBL1064901 0.89 TGFBR1 (0.82) TGFBR1MAPK14HPGDKDM4EALDH1A1
SCHEMBL4868573 0.88 ABCG2 (1.00) TGFBR1MAPK14HPGDKDM4EALDH1A1
SCHEMBL3460305 0.87 ALDH1A1 (0.94) TGFBR1MAPK14HPGDKDM4EALDH1A1
SCHEMBL1064930 0.87 TGFBR1 (0.78) TGFBR1MAPK14HPGDKDM4EALDH1A1
SCHEMBL22201581 0.86 HPGD (0.81) TGFBR1MAPK14HPGDKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1107959-B1 QUINAZOLINE DERIVATIVES AS MEDICAMENTS SCIOS INC (US) 2006-10-11 EP claimed
US-20050171123-A1 Quinazoline derivatives as medicaments SCIOS, INC. 2005-08-04 US claimed
US-6903096-B2 Quinazoline derivatives as medicaments SCIOS, INC. (US) 2005-06-07 US claimed
CN-1152867-C Quinazoline derivatives as medicaments �����ɷ� 2004-06-09 CN claimed
US-20030069248-A1 Quinazoline derivatives as medicaments CHAKRAVARTY SARVAJIT (US) 2003-04-10 US claimed
US-6476031-B1 Quinazoline derivatives as medicaments SCIOS, INC. 2002-11-05 US claimed
US-20020161010-A1 Quinazoline derivatives as medicaments CHAKRAVARTY SARVAJIT (US) 2002-10-31 US claimed
JP-2002523502-A 2002-07-30 JP claimed
CN-1333757-A Quinazoline derivatives as medicaments SCIOS INC (US) 2002-01-30 CN claimed
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 claimed
EP-1107959-A2 QUINAZOLINE DERIVATIVES AS MEDICAMENTS SCIOS INC. (US) 2001-06-20 EP claimed
US-6184226-B1 ANTIINFLAMMATORY AGENTS FOR TREATMENT OF CARDIOVASCULAR SYSTEM DISORDERS/RESPIRATORY SYSTEM DISORDERS, ANTIISCHEMIC AGENTS SCIOS INC. 2001-02-06 US claimed
WO-2000012497-A2 QUINAZOLINE DERIVATIVES AS MEDICAMENTS SCIOS INC. (US) 2000-03-09 WO claimed
US-20140120621-A1 TGF-BETA RECEPTOR INHIBITORS TO ENHANCE DIRECT REPROGRAMMING THE GENERAL HOSPITAL CORPORATION (US) 2014-05-01 US disclosed
US-8603818-B1 TGF-beta receptor inhibitors to enhance direct reprogramming THE GENERAL HOSPITAL CORPORATION (US) 2013-12-10 US disclosed
US-8298825-B1 TGF-beta receptor inhibitors to enhance direct reprogramming THE GENERAL HOSPITAL CORPORATION (US) 2012-10-30 US 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
EP-1107959-A2 QUINAZOLINE DERIVATIVES AS MEDICAMENTS SCIOS INC. (US) 2001-06-20 EP disclosed
US-6184226-B1 ANTIINFLAMMATORY AGENTS FOR TREATMENT OF CARDIOVASCULAR SYSTEM DISORDERS/RESPIRATORY SYSTEM DISORDERS, ANTIISCHEMIC AGENTS SCIOS INC. 2001-02-06 US disclosed
WO-2000012497-A2 QUINAZOLINE DERIVATIVES AS MEDICAMENTS SCIOS INC. (US) 2000-03-09 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 (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-20020161010-A1 Quinazoline derivatives as medicaments SMAD3, SMAD2, TGFBR1 TGFBR1 3/4885MAPK14 24/4885HPGD 1744/4885
US-20050171123-A1 Quinazoline derivatives as medicaments TGFBR2, SMAD2, ADRB2 TGFBR1 4/4885MAPK14 40/4885HPGD 2352/4885
US-20030069248-A1 Quinazoline derivatives as medicaments SMAD3, SMAD2, TGFBR1 TGFBR1 3/4885MAPK14 24/4885HPGD 1744/4885

“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.