SCHEMBL3429111

SCHEMBL3429111

[O]CCCN1C(=O)CCC1CO

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 6/20 0.38
PTGER3 P43115 6/20 0.38
PTGER2 P43116 5/20 0.38
PDK2 Q15119 2/20 0.37
BRD4 O60885 1/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
KMT2A Q03164 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
SCHEMBL1712920 0.89 PDK2 (0.39) PTGER4PTGER3PTGER2PDK2BRD4
SCHEMBL1712647 0.87 PDK2 (0.41) PTGER4PTGER3PTGER2PDK2BRD4
SCHEMBL6195462 0.84 PTGER4 (0.37) PTGER4PTGER3PTGER2PDK2BRD4
SCHEMBL6195464 0.84 PTGER4 (0.37) PTGER4PTGER3PTGER2PDK2BRD4
SCHEMBL1712652 0.83 PDK2 (0.39) PTGER4PTGER3PTGER2PDK2BRD4
SCHEMBL14092774 0.83 PTGER4 (0.53) PTGER4PTGER3PTGER2MEN1POLB
SCHEMBL3682030 0.83 PTGER4 (0.39) PTGER4PTGER3PTGER2PDK2BRD4
SCHEMBL6437112 0.83 PTGER4 (0.39) PTGER4PTGER3PTGER2PDK2BRD4
SCHEMBL11624805 0.79 PTGER4 (0.59) PTGER4PTGER3PTGER2
SCHEMBL8486360 0.79 PDK2 (0.36) PTGER4PTGER3PTGER2PDK2BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7691867-B2 Chemical compounds ASTRAZENECA AB (SE) 2010-04-06 US disclosed
EP-1613619-B1 QUINAZOLINE DERIVATIVES FOR TREATMENT OF CANCER ASTRAZENECA AB (SE) 2008-03-26 EP disclosed
US-20060270692-A1 Chemical compounds ASTRAZENECA AB (SE) 2006-11-30 US disclosed
EP-1613619-A1 QUINAZOLINE DERIVATIVES FOR TREATMENT OF CANCER AstraZeneca AB (SE) 2006-01-11 EP disclosed
WO-2004094410-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2004-11-04 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-20060270692-A1 Chemical compounds CCNI, MKI67, TP53 PTGER4 1125/4885PTGER3 1257/4885PTGER2 1023/4885

“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.