SCHEMBL547065

SCHEMBL547065

CCO[Si](CCCOc1ccc(N2CCCCCC2=O)cc1)(OCC)OCC

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.46
HTT P42858 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
PKM P14618 1/20 0.46
KDM1A O60341 2/20 0.42
HRH3 Q9Y5N1 6/20 0.41
ALDH1A1 P00352 1/20 0.41
USP2 O75604 1/20 0.41
TSHR P16473 1/20 0.40
KCNH2 Q12809 3/20 0.40
HRH1 P35367 1/20 0.40
F2 P00734 1/20 0.40
F10 P00742 1/20 0.40
MAPT P10636 1/20 0.39
RECQL P46063 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL546204 0.99 LMNA (0.47) LMNAHTTSMN1; SMN2PKMKDM1A
SCHEMBL546164 0.95 LMNA (0.50) LMNAHTTSMN1; SMN2PKMKDM1A
SCHEMBL546307 0.88 HTT (0.47) LMNAHTTSMN1; SMN2PKMKDM1A
SCHEMBL547454 0.87 HTT (0.48) LMNAHTTSMN1; SMN2PKMKDM1A
SCHEMBL546226 0.83 HTT (0.52) LMNAHTTSMN1; SMN2PKMKDM1A
SCHEMBL547076 0.81 USP2 (0.39) LMNAALDH1A1USP2F2F10
SCHEMBL546621 0.80 USP2 (0.39) LMNAHTTSMN1; SMN2PKMALDH1A1
SCHEMBL6552462 0.77 LMNA (0.61) LMNAHTTSMN1; SMN2PKMALDH1A1
SCHEMBL546774 0.76 ALDH1A1 (0.42) LMNAHTTSMN1; SMN2PKMALDH1A1
SCHEMBL11815755 0.74 SMN1; SMN2 (0.49) LMNAHTTSMN1; SMN2PKMHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8110635-B2 Method for producing conjugated diene polymer, conjugated diene polymer, and polymer composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-02-07 US claimed
US-20090005497-A1 METHOD FOR PRODUCING CONJUGATED DIENE POLYMER, CONJUGATED DIENE POLYMER, AND POLYMER COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-01-01 US claimed
US-8110635-B2 Method for producing conjugated diene polymer, conjugated diene polymer, and polymer composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-02-07 US disclosed
US-20090005497-A1 METHOD FOR PRODUCING CONJUGATED DIENE POLYMER, CONJUGATED DIENE POLYMER, AND POLYMER COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-01-01 US disclosed