SCHEMBL4867976

SCHEMBL4867976

COc1cccc(CNc2nc(C)nc3ccccc23)c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 4/20 0.76
MEN1 O00255 4/20 0.71
KMT2A Q03164 4/20 0.71
SMN1; SMN2 Q16637 3/20 0.68
LMNA P02545 4/20 0.67
USP2 O75604 4/20 0.67
CYP1A2 P05177 4/20 0.67
CYP3A4 P08684 4/20 0.67
CYP2D6 P10635 4/20 0.67
TSHR P16473 4/20 0.67
CYP2C19 P33261 4/20 0.67
MAPK1 P28482 3/20 0.67
CYP2C9 P11712 3/20 0.67
CLK4 Q9HAZ1 2/20 0.67
ALDH1A1 P00352 1/20 0.67
HSD17B10 Q99714 1/20 0.67
MAPT P10636 1/20 0.65
ACP1 P24666 1/20 0.58
SLC2A1 P11166 1/20 0.56
TP53 P04637 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
SCHEMBL2587104 0.88 APP (0.76) APPMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL3108468 0.86 APP (0.74) APPMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL2817787 0.86 APP (0.74) APPKMT2ASMN1; SMN2LMNAUSP2
SCHEMBL4865131 0.85 CYP1A2 (0.87) APPMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL4866326 0.85 APP (0.73) APPMEN1KMT2ASMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL2395193 0.85 APP (0.73) APPKMT2ASMN1; SMN2LMNAUSP2
SCHEMBL4892836 0.84 MEN1 (0.81) APPMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL4863020 0.84 APP (0.71) APPMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL4863323 0.84 APP (0.71) APPMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL12188795 0.84 KCNH2 (0.60) APPMEN1KMT2ASMN1; SMN2LMNA

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 4386/4885MEN1 3837/4885KMT2A 1662/4885

“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.