SCHEMBL817705

SCHEMBL817705

CCOC(=O)C1=CC=CC(C)(C(=O)OCC)C=C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.36
LMNA P02545 3/20 0.36
MAPT P10636 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 3/20 0.35
GAA P10253 2/20 0.34
POLB P06746 1/20 0.34
ALDH1A1 P00352 4/20 0.34
GLA P06280 1/20 0.34
CA12 O43570 3/20 0.33
CA1 P00915 3/20 0.33
CA2 P00918 3/20 0.33
CA7 P43166 3/20 0.33
CA9 Q16790 3/20 0.33
CA14 Q9ULX7 3/20 0.33
TP53 P04637 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL817577 0.79 KDM4E (0.36) KDM4ELMNAMAPTMEN1KMT2A
SCHEMBL819378 0.74 CA12 (0.34) KDM4ELMNAALDH1A1CA12CA1
SCHEMBL5552082 0.68 TSHR (0.39) KDM4ELMNAMAPTMEN1KMT2A
SCHEMBL11543791 0.68 KDM4E (0.37) KDM4ELMNAMAPTMEN1KMT2A
SCHEMBL12346108 0.67 POLB (0.35) KDM4ELMNAMAPTMEN1KMT2A
SCHEMBL13280876 0.67 POLB (0.32) MEN1KMT2ATSHRPOLBALDH1A1
SCHEMBL28802419 0.67 KDM4E (0.39) KDM4ELMNAMAPTMEN1KMT2A
SCHEMBL30074148 0.65 OPRM1 (0.35) MEN1KMT2ATSHRPOLBSMN1; SMN2
SCHEMBL29066545 0.64 KDM4E (0.36) KDM4ELMNAMAPTMEN1KMT2A
SCHEMBL28889625 0.63 KDM4E (0.35) KDM4ELMNAMAPTMEN1KMT2A

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
US-8236908-B2 Components and catalysts for the polymerization of olefins SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-07 US disclosed
US-20110269927-A1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-03 US disclosed