SCHEMBL4867641

SCHEMBL4867641

Clc1cccc(CCNc2nc(-c3ccccc3)nc3ccccc23)c1

nearest known ligand 0.78

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 10/20 0.78
MAPK1 P28482 2/20 0.66
KDM4E B2RXH2 1/20 0.66
GBA1 P04062 4/20 0.62
MEN1 O00255 4/20 0.61
KMT2A Q03164 4/20 0.61
MAPT P10636 2/20 0.61
GAA P10253 1/20 0.61
SLC6A3 Q01959 2/20 0.61
ABCG2 Q9UNQ0 1/20 0.60
ATM Q13315 1/20 0.60
APP P05067 1/20 0.59
LMNA P02545 1/20 0.58

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
SCHEMBL2590473 0.88 PDE5A (1.00) PDE5AMAPK1KDM4EGBA1MEN1
SCHEMBL1085431 0.87 PDE5A (1.00) PDE5AMAPK1KDM4EGBA1MEN1
SCHEMBL4868215 0.86 PDE5A (0.82) PDE5AMAPK1KDM4EGBA1MEN1
SCHEMBL4868103 0.86 PDE5A (0.82) PDE5AMAPK1KDM4EGBA1MEN1
SCHEMBL4856772 0.85 GBA1 (0.82) PDE5AMAPK1KDM4EGBA1MEN1
SCHEMBL5100868 0.85 PDE5A (0.72) PDE5AMAPK1KDM4EGBA1MEN1
SCHEMBL4913681 0.85 GBA1 (0.71) PDE5AMAPK1KDM4EGBA1MEN1
SCHEMBL5113059 0.83 PDE5A (0.64) PDE5AMAPK1KDM4EGBA1MEN1
SCHEMBL5101416 0.83 PDE5A (0.72) PDE5AMAPK1KDM4EGBA1MEN1
SCHEMBL1064866 0.82 PDE5A (0.86) PDE5AMAPK1GBA1MEN1KMT2A

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 7 patents. 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-20080207614-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF DIABETES AND OBESITY SK CHEMICALS CO., LTD. (KR) 2008-08-28 US disclosed
EP-1844023-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF DIABETES AND OBESITY SK CHEMICALS CO., LTD. (KR) 2007-10-17 EP 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20080207614-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF DIABETES AND OBESITY GPR119, GCKR, GLP1R PDE5A 204/4885MAPK1 513/4885KDM4E 1731/4885

“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.