SCHEMBL4876540

SCHEMBL4876540

CCCCc1c(C(=O)OCC)n[nH]c1[Si](C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.44
POLB P06746 1/20 0.43
PDE4D Q08499 1/20 0.41
HCAR2 Q8TDS4 3/20 0.40
FBP1 P09467 2/20 0.39
MAPT P10636 2/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
ALOX15 P16050 1/20 0.36
LMNA P02545 1/20 0.35
ALDH1A1 P00352 2/20 0.35
HCAR3 P49019 1/20 0.35
CYP1A2 P05177 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL4877595 0.81 KDM4E (0.49) KDM4EPOLBPDE4DHCAR2MAPT
SCHEMBL3956111 0.75 HCAR2 (0.68) KDM4EPOLBPDE4DHCAR2MAPT
SCHEMBL5569375 0.74 HCAR2 (0.43) KDM4EPOLBPDE4DHCAR2MAPT
SCHEMBL23112395 0.73 KDM4E (0.48) KDM4EPOLBPDE4DMAPTKMT2A
SCHEMBL5763853 0.72 KDM4E (0.47) KDM4EPOLBPDE4DMAPTKMT2A
SCHEMBL7814443 0.70 PDE4D (0.58) KDM4EPOLBPDE4DHCAR2MAPT
SCHEMBL9025999 0.70 PDE4D (0.53) KDM4EPOLBPDE4DMAPTKMT2A
SCHEMBL7309807 0.70 ALDH1A1 (0.44) KDM4EPOLBMAPTKMT2ALMNA
SCHEMBL26103963 0.70 MAPT (0.47) KDM4EPOLBMAPTKMT2AMEN1
SCHEMBL12225758 0.69 HCAR2 (0.51) KDM4EPOLBHCAR2MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080090836-A1 Pyrazole Compounds Useful In The Treatment Of Inflammation BIOLIPOX AB (SE) 2008-04-17 US disclosed
EP-1794130-A1 PYRAZOLE COMPOUNDS USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-06-13 EP disclosed
WO-2006032852-A1 PYRAZOLE COMPOUNDS USEFUL UIN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2006-03-30 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-20080090836-A1 Pyrazole Compounds Useful In The Treatment Of Inflammation ALOX15, ALOX15B, ALOX12 KDM4E 3158/4885POLB 2242/4885PDE4D 2303/4885

“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.