SCHEMBL4864609

SCHEMBL4864609

CCCc1nc(NCc2cc(OC)cc(OC)c2)c2ccccc2n1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 6/20 0.57
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
LMNA P02545 3/20 0.53
CYP1A2 P05177 3/20 0.53
CYP3A4 P08684 3/20 0.53
CYP2D6 P10635 3/20 0.53
TSHR P16473 3/20 0.53
MAPK1 P28482 3/20 0.53
CYP2C19 P33261 3/20 0.53
HSD17B10 Q99714 2/20 0.53
USP2 O75604 2/20 0.53
CLK4 Q9HAZ1 2/20 0.53
ALDH1A1 P00352 1/20 0.53
CYP2C9 P11712 1/20 0.53
ACHE P22303 7/20 0.52
BCHE P06276 5/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
SLC2A1 P11166 1/20 0.51
MAPT P10636 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
SCHEMBL4868169 0.91 APP (0.70) APPMEN1KMT2ALMNACYP1A2
SCHEMBL4864375 0.91 APP (0.60) APPMEN1KMT2ALMNACYP1A2
SCHEMBL4866944 0.89 APP (0.68) APPLMNACYP1A2CYP3A4CYP2D6
SCHEMBL4866192 0.87 APP (0.61) APPMEN1KMT2ALMNACYP1A2
SCHEMBL5104517 0.86 ACHE (0.58) APPMEN1KMT2ALMNACYP1A2
SCHEMBL4866399 0.86 CYP1A2 (0.50) APPMEN1KMT2ALMNACYP1A2
SCHEMBL4859221 0.84 ACHE (0.74) APPMEN1KMT2AACHEBCHE
SCHEMBL4863020 0.82 APP (0.71) APPMEN1KMT2ALMNACYP1A2
SCHEMBL5101338 0.82 CYP1A2 (0.56) APPMEN1KMT2ALMNACYP1A2
SCHEMBL5100860 0.82 CYP1A2 (0.67) MEN1KMT2ALMNACYP1A2CYP3A4

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.