SCHEMBL3470104

SCHEMBL3470104

COC(=O)c1cc(OC(C)OC)c(OC(C)OC)cc1N

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.67
ALDH1A1 P00352 5/20 0.47
GAA P10253 5/20 0.47
HSD17B10 Q99714 4/20 0.47
MAPT P10636 2/20 0.47
HPGD P15428 2/20 0.47
GLA P06280 2/20 0.47
CASP1 P29466 1/20 0.47
CASP7 P55210 1/20 0.47
ATM Q13315 1/20 0.47
ABL1 P00519 1/20 0.46
TSHR P16473 2/20 0.45
POLB P06746 2/20 0.45
ALOX15 P16050 1/20 0.45
CFTR P13569 7/20 0.44
USP2 O75604 1/20 0.36
HTT P42858 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35

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
SCHEMBL264388 0.84 KDM4E (0.47) KDM4EALDH1A1GAAHSD17B10MAPT
SCHEMBL2857865 0.84 KDM4E (0.78) KDM4EALDH1A1GAAHSD17B10MAPT
SCHEMBL372600 0.80 KDM4E (1.00) KDM4EALDH1A1GAAHSD17B10MAPT
SCHEMBL31408659 0.80 KDM4E (1.00) KDM4EALDH1A1GAAHSD17B10MAPT
SCHEMBL31716930 0.80 KDM4E (0.76) KDM4EALDH1A1GAAHSD17B10MAPT
SCHEMBL267611 0.79 KDM4E (0.55) KDM4EALDH1A1GAAHSD17B10MAPT
SCHEMBL4758833 0.78 KDM4E (0.73) KDM4EALDH1A1GAAHSD17B10MAPT
SCHEMBL19554257 0.76 GAA (0.59) KDM4EALDH1A1GAAHSD17B10MAPT
SCHEMBL5692887 0.76 KDM4E (0.70) KDM4EALDH1A1GAAHSD17B10MAPT
SCHEMBL2900351 0.75 KDM4E (0.82) KDM4EALDH1A1GAAHSD17B10MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011147102-A1 SYNTHETIC METHOD FOR 6,7-SUBSTITUENTS-4-ANILINE QUINAZOLINE 翔真生物科技股份有限公司 (CN) 2011-12-01 WO disclosed
US-20100267949-A1 Method of Synthesizing 6,7-Substituted 4-Anilino Quinazoline OMEGA MEDICAL TAIWAN LIMITED (TW) 2010-10-21 US 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-20100267949-A1 Method of Synthesizing 6,7-Substituted 4-Anilino Quinazoline NQO2, ATIC, CYP3A7 KDM4E 2145/4885ALDH1A1 878/4885GAA 927/4885

“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.