SCHEMBL819019

SCHEMBL819019

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPT P10636 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.36
CA12 O43570 3/20 0.34
CA1 P00915 3/20 0.34
CA2 P00918 3/20 0.34
CA7 P43166 3/20 0.34
CA9 Q16790 3/20 0.34
CA14 Q9ULX7 3/20 0.34
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
LMNA P02545 2/20 0.33
CYP1A2 P05177 2/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 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
SCHEMBL819312 0.88 ALDH1A1 (0.39) KDM4EMEN1KMT2AMAPTALOX15
SCHEMBL817721 0.84 TSHR (0.43) KDM4EMAPTTSHRESR1LMNA
SCHEMBL818677 0.84 ALDH1A1 (0.41) MAPTTSHRCHRM2CHRM4CHRM5
SCHEMBL817173 0.83 ALDH1A1 (0.44) KDM4EMAPTTSHRESR1LMNA
SCHEMBL818056 0.78 ALDH1A1 (0.50) MEN1KMT2AMAPTTSHRCA2
SCHEMBL12808756 0.76 MEN1 (0.43) KDM4EMEN1KMT2AMAPTALOX15
SCHEMBL817914 0.75 SLC6A2 (0.36) KDM4EMEN1KMT2AMAPTALOX15
SCHEMBL818824 0.73 KMT2A (0.41) KDM4EMEN1KMT2AMAPTALOX15
SCHEMBL818449 0.72 KDM4E (0.40) KDM4EMEN1KMT2AMAPTALOX15
SCHEMBL5608026 0.69 KDM4E (0.59) KDM4EMEN1KMT2AMAPTALOX15

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