SCHEMBL525626

SCHEMBL525626

COCCOCCOCCN(CCOc1cc(CO)nc(CO)c1)CCC(=O)OC

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 7/20 0.34
PDE3A Q14432 7/20 0.34
P2RY12 Q9H244 6/20 0.34
LTA4H P09960 3/20 0.33
PDE2A O00408 2/20 0.33
PPARG P37231 1/20 0.32
HPRT1 P00492 1/20 0.32
LMNA P02545 1/20 0.32
CA2 P00918 2/20 0.31
DYRK1A Q13627 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL18900388 0.86 HPRT1 (0.32) PDE3BPDE3AP2RY12LTA4HPDE2A
SCHEMBL526245 0.85 CA2 (0.32) PDE3BPDE3AP2RY12LTA4HPDE2A
SCHEMBL525915 0.84 CYSLTR2 (0.40) PDE3BPDE3AP2RY12LTA4HPPARG
SCHEMBL14973527 0.83 PDE3B (0.38) PDE3BPDE3AP2RY12LTA4HPDE2A
SCHEMBL2492655 0.81 DYRK1A (0.39) PDE3BPDE3AP2RY12LTA4HPDE2A
SCHEMBL2491001 0.77 PDE3B (0.47) PDE3BPDE3AP2RY12LTA4HPDE2A
SCHEMBL525627 0.76 DYRK1A (0.37) PDE3BPDE3AP2RY12LTA4HPDE2A
SCHEMBL14973639 0.75 PDE3B (0.34) PDE3BPDE3AP2RY12PDE2APPARG
SCHEMBL525971 0.75 LMNA (0.30) LMNA
SCHEMBL525934 0.75 CYSLTR2 (0.39) PDE3BPDE3AP2RY12LTA4HPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2598507-B1 ANTICANCER DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2017-05-31 EP disclosed
EP-2598507-B1 ANTICANCER DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2017-05-31 EP disclosed
US-9056914-B2 Anticancer derivatives, preparation thereof and therapeutic use thereof SANOFI (FR) 2015-06-16 US disclosed
US-9056914-B2 Anticancer derivatives, preparation thereof and therapeutic use thereof SANOFI (FR) 2015-06-16 US disclosed
US-9056914-B2 Anticancer derivatives, preparation thereof and therapeutic use thereof SANOFI (FR) 2015-06-16 US disclosed
EP-2598507-A1 ANTICANCER DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2013-06-05 EP disclosed
US-20130137659-A1 ANTICANCER DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2013-05-30 US disclosed
US-20130137659-A1 ANTICANCER DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2013-05-30 US disclosed
US-20130137659-A1 ANTICANCER DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2013-05-30 US disclosed
WO-2012014147-A1 ANTICANCER DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-02-02 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-20130137659-A1 ANTICANCER DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF MCL1, TP53, MYC PDE3B 3420/4885PDE3A 3723/4885P2RY12 4733/4885

“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.