SCHEMBL5569375

SCHEMBL5569375

CCCCc1c(C(=O)OCC)n[nH]c1CC(C)(C)O

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 4/20 0.43
KDM4E B2RXH2 3/20 0.41
POLB P06746 2/20 0.40
PDE4D Q08499 1/20 0.38
HCAR3 P49019 1/20 0.35
MAPT P10636 3/20 0.33
KMT2A Q03164 2/20 0.33
LMNA P02545 1/20 0.33
MEN1 O00255 1/20 0.33
ALOX15 P16050 1/20 0.33
CYP1A2 P05177 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL3956111 0.76 HCAR2 (0.68) HCAR2KDM4EPOLBPDE4DHCAR3
SCHEMBL4876540 0.74 KDM4E (0.44) HCAR2KDM4EPOLBPDE4DHCAR3
SCHEMBL3389520 0.70 KDM4E (0.43) HCAR2KDM4EPOLBPDE4DMAPT
SCHEMBL2869702 0.70 KDM4E (0.46) HCAR2KDM4EPOLBPDE4DMAPT
SCHEMBL23112395 0.69 KDM4E (0.48) KDM4EPOLBPDE4DMAPTKMT2A
SCHEMBL9025212 0.68 HCAR2 (0.66) HCAR2KDM4EPOLBPDE4DMAPT
SCHEMBL5763853 0.68 KDM4E (0.47) KDM4EPOLBPDE4DMAPTKMT2A
SCHEMBL24235249 0.67 KDM4E (0.46) KDM4EPOLBPDE4DMAPTKMT2A
SCHEMBL5572083 0.67 HCAR2 (0.43) HCAR2KDM4EPOLBPDE4DMAPT
SCHEMBL7814443 0.66 PDE4D (0.58) HCAR2KDM4EPOLBPDE4DMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1863809-A2 PYRAZOLOPYRIDINES AND ANALOGS THEREOF Coley Pharmaceutical Group, Inc. (US) 2007-12-12 EP disclosed
WO-2006107753-A2 PYRAZOLOPYRIDINES AND ANALOGS THEREOF COLEY PHARMACEUTICAL GROUP, INC. (US) 2006-10-12 WO disclosed