SCHEMBL4909339

SCHEMBL4909339

CCSc1nc(NCCN2CCCC2)c2ccccc2n1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 1/20 0.57
ACP1 P24666 3/20 0.55
SLC2A1 P11166 2/20 0.51
HSD17B10 Q99714 4/20 0.49
CYP1A2 P05177 4/20 0.49
CYP3A4 P08684 4/20 0.49
CYP2D6 P10635 4/20 0.49
ALOX15 P16050 3/20 0.49
USP2 O75604 2/20 0.49
TDP1 Q9NUW8 1/20 0.49
KAT2B Q92831 2/20 0.49
ADRA2A P08913 1/20 0.49
ADRA2B P18089 1/20 0.49
ADRA2C P18825 1/20 0.49
SMARCA2 P51531 1/20 0.49
HRH3 Q9Y5N1 3/20 0.48
CLK4 Q9HAZ1 3/20 0.47
LMNA P02545 3/20 0.47
MEN1 O00255 3/20 0.47
MAPT P10636 3/20 0.47

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
SCHEMBL4909303 0.99 TOP2A (0.59) TOP2AACP1SLC2A1HSD17B10CYP1A2
SCHEMBL4897390 0.90 CYP1A2 (0.62) TOP2AACP1HSD17B10CYP1A2CYP3A4
SCHEMBL4920191 0.83 ALOX15 (0.67) TOP2AACP1HSD17B10CYP1A2CYP3A4
SCHEMBL4910412 0.80 SLC2A1 (0.65) ACP1SLC2A1HSD17B10CYP3A4HRH3
SCHEMBL1091141 0.80 TOP2A (0.64) TOP2AACP1SLC2A1HSD17B10CYP1A2
SCHEMBL4865325 0.80 MAPK1 (0.57) SLC2A1USP2LMNAMAPTKMT2A
SCHEMBL4867045 0.80 ACP1 (0.63) ACP1SLC2A1LMNAMAPTALDH1A1
SCHEMBL1090545 0.79 TOP2A (0.67) TOP2AACP1SLC2A1HSD17B10CYP1A2
SCHEMBL4089490 0.79 TOP2A (0.63) TOP2AACP1HSD17B10CYP1A2CYP3A4
SCHEMBL4864553 0.79 LMNA (0.65) TDP1LMNAMAPTKMT2ATP53

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 TOP2A 2962/4885ACP1 3203/4885SLC2A1 21/4885

“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.