SCHEMBL13865269

SCHEMBL13865269

CCOC(=O)CCc1cccc(NCl)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.51
CYP4A11 Q02928 2/20 0.51
SYK P43405 5/20 0.48
MAPT P10636 1/20 0.47
SIRT2 Q8IXJ6 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
CYP4Z1 Q86W10 1/20 0.45
BRD4 O60885 1/20 0.44
PDE3B Q13370 1/20 0.44
PDE3A Q14432 1/20 0.44
P2RY12 Q9H244 1/20 0.44
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
ALDH1A1 P00352 1/20 0.42

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
SCHEMBL16316705 0.89 CYP4F2 (0.49) CYP4F2CYP4A11SYKMAPTSIRT2
SCHEMBL30967793 0.87 CYP4F2 (0.53) CYP4F2CYP4A11SYKMAPTSIRT2
SCHEMBL2082531 0.86 CYP4F2 (0.51) CYP4F2CYP4A11SYKMAPTSIRT2
SCHEMBL4425984 0.85 CYP4F2 (0.64) CYP4F2CYP4A11SYKTDP1CYP4Z1
SCHEMBL13879886 0.82 CYP4F2 (0.66) CYP4F2CYP4A11SYKMAPTTDP1
SCHEMBL8616029 0.81 SYK (0.50) CYP4F2CYP4A11SYKMAPTSIRT2
SCHEMBL901671 0.81 CYP4F2 (0.55) CYP4F2CYP4A11MAPTTDP1CYP4Z1
SCHEMBL13104077 0.80 CYP4F2 (0.58) CYP4F2CYP4A11SYKMAPTTDP1
SCHEMBL879289 0.80 CYP4F2 (0.58) CYP4F2CYP4A11SYKTDP1CYP4Z1
SCHEMBL11064964 0.80 CYP4F2 (0.46) CYP4F2CYP4A11SYKMAPTSIRT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7531566-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2009-05-12 US disclosed
US-20090105230-A1 Anti-inflammatory medicaments FLYNN DANIEL L 2009-04-23 US disclosed
US-20080132506-A1 Anti-inflammatory medicaments FLYNN DANIEL L 2008-06-05 US disclosed
US-20080064688-A1 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC 2008-03-13 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 (3 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-20080064688-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF CYP4F2 4421/4885CYP4A11 3407/4885SYK 349/4885
US-20090105230-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF CYP4F2 4421/4885CYP4A11 3407/4885SYK 349/4885
US-20080132506-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF CYP4F2 4421/4885CYP4A11 3407/4885SYK 349/4885

“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.