SCHEMBL307648

SCHEMBL307648

COC(=O)CC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.62
ALDH1A1 P00352 2/20 0.51
EPHX2 P34913 3/20 0.49
L3MBTL1 Q9Y468 2/20 0.48
NPC1 O15118 1/20 0.47
MAPT P10636 1/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
HPGD P15428 1/20 0.47
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
RECQL P46063 1/20 0.45
PTPN2 P17706 1/20 0.44
PTPN1 P18031 1/20 0.44
PTPN6 P29350 1/20 0.44
KDM4E B2RXH2 1/20 0.43
PKM P14618 1/20 0.43

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
SCHEMBL14601621 0.92 EPHX1 (0.52) EPHX1ALDH1A1HDAC4
SCHEMBL307482 0.87 EPHX1 (0.63) EPHX1ALDH1A1EPHX2L3MBTL1NPC1
SCHEMBL17936450 0.86 EPHX1 (0.62) EPHX1ALDH1A1EPHX2L3MBTL1NPC1
SCHEMBL10268244 0.85 EPHX1 (0.65) EPHX1ALDH1A1EPHX2L3MBTL1NPC1
SCHEMBL2321232 0.85 EPHX1 (0.65) EPHX1ALDH1A1EPHX2L3MBTL1NPC1
SCHEMBL4206232 0.84 EPHX1 (0.63) EPHX1ALDH1A1EPHX2L3MBTL1NPC1
SCHEMBL13459878 0.84 EPHX1 (0.63) EPHX1ALDH1A1EPHX2L3MBTL1NPC1
SCHEMBL3251359 0.83 EPHX1 (0.67) EPHX1ALDH1A1EPHX2L3MBTL1NPC1
SCHEMBL21738867 0.83 EPHX1 (0.62) EPHX1ALDH1A1EPHX2L3MBTL1NPC1
SCHEMBL2016955 0.82 EPHX1 (0.68) EPHX1ALDH1A1EPHX2L3MBTL1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8329726-B2 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC. (CA) 2012-12-11 US disclosed
US-20120083482-A1 INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING METHYLGENE INC. 2012-04-05 US disclosed
US-8093264-B2 Fused heterocycles as inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC. (CA) 2012-01-10 US disclosed
EP-1957498-A2 INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING MethylGene Inc. (CA) 2008-08-20 EP disclosed
WO-2008041053-A2 INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING METHYLGENE, INC. (CA) 2008-04-10 WO disclosed
US-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE, INC. 2007-01-04 US disclosed
US-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE, INC. 2007-01-04 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 (2 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-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling HGF, MET, FLT1 EPHX1 2528/4885ALDH1A1 1649/4885EPHX2 2959/4885
US-20120083482-A1 INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING HGF, MET, KDR EPHX1 1955/4885ALDH1A1 411/4885EPHX2 1179/4885

“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.