SCHEMBL5107686

SCHEMBL5107686

COC(c1ccccc1)c1nc(N(C)c2ccc3c(c2)OCO3)c2ccccc2n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.49
USP2 O75604 2/20 0.49
CYP1A2 P05177 2/20 0.49
CYP3A4 P08684 2/20 0.49
CYP2D6 P10635 2/20 0.49
CYP2C19 P33261 2/20 0.49
CLK4 Q9HAZ1 2/20 0.49
LMNA P02545 1/20 0.49
CYP2C9 P11712 1/20 0.49
ALOX15 P16050 1/20 0.49
EGFR P00533 4/20 0.46
PDGFRB P09619 4/20 0.46
KDR P35968 4/20 0.46
PDGFRA P16234 1/20 0.46
EDNRA P25101 7/20 0.43
ALDH1A1 P00352 2/20 0.41
TSHR P16473 2/20 0.41
RECQL P46063 1/20 0.41
GBA1 P04062 1/20 0.40
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL4890869 0.86 USP2 (0.52) HSD17B10USP2CYP1A2CYP3A4CYP2D6
SCHEMBL4890500 0.85 USP2 (0.55) HSD17B10USP2CYP1A2CYP3A4CYP2D6
SCHEMBL5107707 0.79 EGFR (0.67) HSD17B10USP2CYP1A2CYP3A4CYP2D6
SCHEMBL5107758 0.78 CYP1A2 (0.74) HSD17B10USP2CYP1A2CYP3A4CYP2D6
SCHEMBL3114792 0.78 EGFR (0.57) HSD17B10USP2CYP1A2CYP3A4CYP2D6
SCHEMBL4884533 0.76 USP2 (0.55) HSD17B10USP2CYP1A2CYP3A4CYP2D6
SCHEMBL5104641 0.76 CYP1A2 (0.55) HSD17B10USP2CYP1A2CYP3A4CYP2D6
SCHEMBL4887890 0.76 USP2 (0.52) HSD17B10USP2CYP1A2CYP3A4CYP2D6
SCHEMBL5107474 0.74 CYP1A2 (0.53) HSD17B10USP2CYP1A2CYP3A4CYP2D6
SCHEMBL4893642 0.74 USP2 (0.53) HSD17B10USP2CYP1A2CYP3A4CYP2D6

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 3 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 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 HSD17B10 1462/4885USP2 2716/4885CYP1A2 528/4885

“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.