SCHEMBL5596484

SCHEMBL5596484

COc1cc(C)c(O)c(P(c2cc(OC)cc(C)c2O)[Si](C)(C)c2ccccc2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
TSHR P16473 2/20 0.38
CYP3A4 P08684 5/20 0.35
MAPT P10636 5/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
TP53 P04637 3/20 0.35
ALDH1A1 P00352 3/20 0.35
ALOX5 P09917 3/20 0.35
PTGS1 P23219 3/20 0.35
PTGS2 P35354 3/20 0.35
HPGD P15428 2/20 0.35
KDM4E B2RXH2 1/20 0.35
USP2 O75604 1/20 0.35
TRPV1 Q8NER1 1/20 0.35
HSD17B10 Q99714 1/20 0.35
GAA P10253 3/20 0.34
BACE1 P56817 1/20 0.34
ABCG2 Q9UNQ0 2/20 0.34
CA4 P22748 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
SCHEMBL5596223 0.89 MEN1 (0.38) MEN1KMT2ATSHRCYP3A4MAPT
SCHEMBL5596075 0.82 ALDH1A1 (0.39) MEN1KMT2AMAPTALDH1A1ALOX5
SCHEMBL5595890 0.80 CYP3A4 (0.39) KMT2ACYP3A4MAPTSMN1; SMN2ALDH1A1
SCHEMBL5596039 0.76 MEN1 (0.41) MEN1KMT2ATSHRCYP3A4MAPT
SCHEMBL5596527 0.75 ALDH1A1 (0.43) KMT2ATSHRCYP3A4MAPTALDH1A1
SCHEMBL5596535 0.73 NPC1 (0.39) MEN1KMT2ATSHRCYP3A4MAPT
SCHEMBL5596343 0.72 MEN1 (0.38) MEN1KMT2ATSHRCYP3A4MAPT
SCHEMBL5596170 0.71 CYP3A4 (0.43) MEN1KMT2ATSHRCYP3A4MAPT
SCHEMBL5596225 0.70 MEN1 (0.37) MEN1KMT2ATSHRCYP3A4MAPT
SCHEMBL5596245 0.70 LMNA (0.39) MEN1KMT2AMAPTALDH1A1ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7279537-B2 Transition metal complexes and polymerization catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-10-09 US disclosed
US-20060229195-A1 Transition metal complexes and polymerization catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-10-12 US disclosed
EP-1557423-A1 TRANSITION METAL COMPLEXES AND POLYMERIZATION CATALYSTS Sumitomo Chemical Company, Limited (JP) 2005-07-27 EP disclosed