SCHEMBL4864862

SCHEMBL4864862

c1ccc(CCNc2nc(Cc3ccccc3)nc3ccccc23)cc1

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
APP P05067 9/20 0.68
ACHE P22303 8/20 0.68
BCHE P06276 6/20 0.68
PDE5A O76074 5/20 0.65
MAPK1 P28482 2/20 0.60
EGFR P00533 1/20 0.60
LMNA P02545 1/20 0.60
HTT P42858 1/20 0.60
KDM4E B2RXH2 1/20 0.59
JAK2 O60674 1/20 0.58
METAP1 P53582 1/20 0.58
PPP1CA P62136 1/20 0.58
KMT2A Q03164 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
GBA1 P04062 1/20 0.55
SLC6A3 Q01959 1/20 0.54
HRH4 Q9H3N8 1/20 0.54

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
SCHEMBL4863010 0.90 GBA1 (0.58) APPACHEBCHEPDE5AMAPK1
SCHEMBL4857481 0.87 LMNA (0.64) APPACHEBCHEPDE5AMAPK1
SCHEMBL4866244 0.87 MAPK1 (0.59) APPACHEBCHEMAPK1LMNA
SCHEMBL4859938 0.84 RAD52 (0.69) APPACHEBCHEPDE5AMAPK1
SCHEMBL4859337 0.81 ACHE (0.50) APPACHEBCHEPDE5AMAPK1
SCHEMBL4856835 0.80 APP (0.69) APPACHEBCHEPDE5AMAPK1
SCHEMBL17799869 0.80 APP (1.00) APPACHEBCHEPDE5AMAPK1
SCHEMBL1085431 0.79 PDE5A (1.00) APPPDE5AMAPK1KDM4EJAK2
SCHEMBL4894183 0.77 RAD52 (0.51) APPACHEBCHEPDE5ALMNA
SCHEMBL4890406 0.77 APP (0.64) APPACHEBCHEPDE5AMAPK1

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 APP 4386/4885ACHE 371/4885BCHE 550/4885

“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.