SCHEMBL4888593

SCHEMBL4888593

CC(C)(C)c1nc(NCc2cccc(F)c2)c2ccccc2n1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNE2 O96020 2/20 0.80
CCNE1 P24864 2/20 0.80
CDK2 P24941 2/20 0.80
APP P05067 8/20 0.68
KMT2A Q03164 4/20 0.60
MEN1 O00255 3/20 0.60
RAD52 P43351 1/20 0.50
MAPT P10636 4/20 0.49
LMNA P02545 3/20 0.49
BCHE P06276 1/20 0.49
ACHE P22303 1/20 0.49
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
PKM P14618 1/20 0.49
UBE2N P61088 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
RCE1 Q9Y256 1/20 0.49
PDE5A O76074 1/20 0.48
POLB P06746 1/20 0.48
MAPK1 P28482 1/20 0.48

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
SCHEMBL5104398 0.88 CCNE2 (0.63) CCNE2CCNE1CDK2APPKMT2A
SCHEMBL4868172 0.87 RAD52 (0.65) CCNE2CCNE1CDK2APPKMT2A
SCHEMBL5107781 0.86 APP (0.71) CCNE2CCNE1CDK2APPKMT2A
SCHEMBL4863396 0.84 APP (0.73) CCNE2CCNE1CDK2APPKMT2A
SCHEMBL4892836 0.83 MEN1 (0.81) CCNE2CCNE1CDK2APPKMT2A
SCHEMBL2580376 0.82 RAD52 (0.76) CCNE2CCNE1CDK2APPKMT2A
SCHEMBL4863308 0.81 APP (0.68) CCNE2CCNE1CDK2APPKMT2A
SCHEMBL4867531 0.80 MEN1 (0.76) CCNE2CCNE1CDK2APPKMT2A
SCHEMBL4861406 0.80 APP (0.71) CCNE2CCNE1CDK2APPKMT2A
SCHEMBL4860088 0.79 APP (0.65) CCNE2CCNE1CDK2APPKMT2A

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 CCNE2 3496/4885CCNE1 3853/4885CDK2 1486/4885

“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.