SCHEMBL818744

SCHEMBL818744

COC(=O)C1=C(C(=O)OC)CC(C)C(C)C=C1

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HSD17B10 Q99714 1/20 0.31
LMNA P02545 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
NFKB1 P19838 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL818661 0.80 ALDH1A1 (0.35) KDM4ENPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL819412 0.77 ALDH1A1 (0.38) KDM4ENPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL12808601 0.77 NPSR1 (0.31) ALDH1A1
SCHEMBL17787819 0.77 NPSR1 (0.31) ALDH1A1
SCHEMBL818180 0.75 SLC6A3 (0.33) KDM4ENPC1SMN1; SMN2ALDH1A1HSD17B10
SCHEMBL818541 0.73 NPSR1 (0.32) KDM4ENPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL6383220 0.71 HTT (0.31) SMN1; SMN2
SCHEMBL818287 0.70 TDP1 (0.40) KDM4EALDH1A1HSD17B10LMNANFKB1
SCHEMBL18287583 0.69 CA12 (0.33) KDM4ENPC1RAB9AALDH1A1LMNA
SCHEMBL12831900 0.68 TSHR (0.32) KDM4ESMN1; SMN2ALDH1A1HSD17B10MAPT

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