SCHEMBL4866041

SCHEMBL4866041

CCSc1nc(NCCCCc2ccccc2)c2ccccc2n1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.56
MAPT P10636 1/20 0.56
GBA1 P04062 2/20 0.54
APP P05067 6/20 0.53
ACHE P22303 5/20 0.53
BCHE P06276 4/20 0.53
CYP1A2 P05177 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C19 P33261 1/20 0.52
CASP6 P55212 1/20 0.52
PDE5A O76074 1/20 0.49
ACP1 P24666 1/20 0.48
ABL1 P00519 1/20 0.48
SRC P12931 1/20 0.48
TP53 P04637 1/20 0.46
KDM4E B2RXH2 1/20 0.45
MAPK1 P28482 1/20 0.45

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
SCHEMBL4868696 0.96 LMNA (0.57) LMNAMAPTGBA1APPACHE
SCHEMBL4864553 0.91 LMNA (0.65) LMNAMAPTAPPACHEBCHE
SCHEMBL4867045 0.87 ACP1 (0.63) LMNAMAPTGBA1APPACHE
SCHEMBL4863793 0.83 APP (0.62) LMNAMAPTGBA1APPACHE
SCHEMBL4865325 0.82 MAPK1 (0.57) LMNAMAPTGBA1APPPDE5A
SCHEMBL4866885 0.80 GBA1 (0.59) LMNAGBA1APPACHEBCHE
SCHEMBL4859114 0.80 LMNA (0.78) LMNAMAPTGBA1APPACHE
SCHEMBL4863789 0.80 GBA1 (0.65) LMNAMAPTGBA1APPCASP6
SCHEMBL4867969 0.80 MAPT (0.59) LMNAMAPTCYP1A2CYP2D6CYP2C19
SCHEMBL4865186 0.78 LMNA (0.59) LMNAMAPTGBA1APPACHE

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 LMNA 3549/4885MAPT 4050/4885GBA1 2919/4885

“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.