SCHEMBL4449175

SCHEMBL4449175

CNC1(C(N)=O)CCN(CCOC)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.45
KDM4E B2RXH2 1/20 0.45
HSD11B1 P28845 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP2D6 P10635 1/20 0.40
TDP1 Q9NUW8 1/20 0.36
HDAC2 Q92769 2/20 0.36
HDAC1 Q13547 1/20 0.36
MMP2 P08253 4/20 0.35
MMP13 P45452 4/20 0.35
MMP14 P50281 4/20 0.35
MMP1 P03956 3/20 0.35
MMP3 P08254 3/20 0.35
MMP9 P14780 3/20 0.35
MMP8 P22894 3/20 0.35
MMP7 P09237 2/20 0.35
MEN1 O00255 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NAMPT P43490 1/20 0.34
CA12 O43570 1/20 0.34

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
SCHEMBL8444064 0.78 KDM4E (0.52) KMT2AKDM4EHSD11B1ALDH1A1CYP2D6
SCHEMBL10280093 0.76 KDM4E (0.57) KMT2AKDM4EALDH1A1CYP2D6TDP1
SCHEMBL3715654 0.71
SCHEMBL14367300 0.71 KDM4E (0.55) KMT2AKDM4EALDH1A1CYP2D6
SCHEMBL3210066 0.70 CYP2D6 (0.76) KMT2AALDH1A1CYP2D6
SCHEMBL2476175 0.69 KDM4E (0.47) KMT2AKDM4EHSD11B1ALDH1A1TDP1
SCHEMBL3216394 0.69 HSD11B1 (0.54) KMT2AKDM4EHSD11B1TDP1NAMPT
SCHEMBL12409052 0.69 HSD11B1 (0.41) KMT2AHSD11B1ALDH1A1TDP1HDAC2
SCHEMBL4445417 0.68 KDM4E (0.52) KMT2AKDM4EALDH1A1CYP2D6MMP2
SCHEMBL6010009 0.68 KDM4E (0.52) KMT2AKDM4EALDH1A1CYP2D6MMP13

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
CN-1914182-B Quinazoline derivatives ASTRAZENECA AB 2011-09-07 CN disclosed
US-7632840-B2 Quinazoline compounds for the treatment of hyperproliferative disorders ASTRAZENECA AB (SE) 2009-12-15 US disclosed
EP-1713781-B1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2008-11-05 EP disclosed
US-20070293490-A1 Quinazoline Derivatives ASTRAZENECA AB (SE) 2007-12-20 US disclosed
CN-1914182-A Quinazoline derivatives ASTRAZENECA AB (SE) 2007-02-14 CN disclosed
EP-1713781-A1 QUINAZOLINE DERIVATIVES AstraZeneca AB (SE) 2006-10-25 EP disclosed
WO-2005075439-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2005-08-18 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-20070293490-A1 Quinazoline Derivatives CCNA1, CCND3, CCND2 KMT2A 398/4885KDM4E 2562/4885HSD11B1 3481/4885

“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.