SCHEMBL4864291

SCHEMBL4864291

C=CCNc1nc(SCC)nc2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.53
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
GLA P06280 1/20 0.53
TSHR P16473 1/20 0.53
NPY1R P25929 1/20 0.53
HSD17B10 Q99714 1/20 0.53
MAPT P10636 4/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
RAB9A P51151 2/20 0.52
GAA P10253 1/20 0.52
SUMO3 P55854 1/20 0.52
SUMO2 P61956 1/20 0.52
SUMO1 P63165 1/20 0.52
HIF1A Q16665 1/20 0.48
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
ALDH1A1 P00352 3/20 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
SCHEMBL4863793 0.81 APP (0.62) KDM4EMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL4866137 0.80 ACP1 (0.60) KDM4EMAPTALDH1A1LMNAMAPK1
SCHEMBL4867045 0.80 ACP1 (0.63) KDM4EMAPTSMN1; SMN2ALDH1A1LMNA
SCHEMBL4865325 0.80 MAPK1 (0.57) KDM4EKMT2AGLATSHRMAPT
SCHEMBL4864553 0.78 LMNA (0.65) KDM4EKMT2AMAPTLMNAMAPK1
SCHEMBL9287754 0.78 SUMO3 (0.72) KDM4EMEN1KMT2AGLATSHR
SCHEMBL4867969 0.77 MAPT (0.59) KDM4EMEN1KMT2ATSHRHSD17B10
SCHEMBL4868696 0.76 LMNA (0.57) MAPTCYP1A2CYP2D6CYP2C19LMNA
SCHEMBL4893411 0.76 LMNA (0.49) KDM4EMEN1KMT2ATSHRMAPT
SCHEMBL4866091 0.76 APP (0.57) KDM4EMEN1KMT2AHSD17B10MAPT

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 KDM4E 1731/4885MEN1 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.