SCHEMBL4860001

SCHEMBL4860001

CCSc1nc(NC2CCCCC2)c2ccccc2n1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 2/20 0.59
ACP1 P24666 2/20 0.59
OGG1 O15527 1/20 0.59
TLR7 Q9NYK1 2/20 0.56
GBA1 P04062 5/20 0.52
MEN1 O00255 1/20 0.51
HSP90AA1 P07900 1/20 0.51
KMT2A Q03164 1/20 0.51
KDM4E B2RXH2 2/20 0.50
HSD17B10 Q99714 1/20 0.50
NPY5R Q15761 1/20 0.50
CCR4 P51679 1/20 0.50
MERTK Q12866 4/20 0.49
LMNA P02545 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL4867312 0.99 ACP1 (0.58) PDE5AACP1OGG1TLR7GBA1
SCHEMBL24649760 0.78 ACP1 (0.68) PDE5AACP1OGG1TLR7GBA1
SCHEMBL27223312 0.77 PDE5A (0.59) PDE5AACP1OGG1TLR7GBA1
SCHEMBL4866091 0.77 APP (0.57) ACP1TLR7MEN1KMT2AKDM4E
SCHEMBL24649614 0.76 NPY5R (0.79) PDE5AACP1OGG1TLR7GBA1
SCHEMBL14256580 0.76 MERTK (0.53) PDE5AACP1OGG1TLR7GBA1
SCHEMBL11732536 0.75 ACP1 (0.68) PDE5AACP1OGG1TLR7GBA1
SCHEMBL12988643 0.75 ACP1 (0.68) PDE5AACP1OGG1TLR7GBA1
SCHEMBL4862541 0.74 ACP1 (1.00) PDE5AACP1OGG1TLR7GBA1
SCHEMBL16280668 0.74 NPY5R (0.62) PDE5AACP1OGG1TLR7GBA1

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 204/4885ACP1 3203/4885OGG1 3583/4885

“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.