SCHEMBL3423554

SCHEMBL3423554

COc1ccc(COC(c2ccccc2)(c2ccc(OC)cc2)C2CC(O)CN2C(=O)CCCCCN(C)C)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.37
CHRM5 P08912 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
BCHE P06276 1/20 0.35
ACHE P22303 1/20 0.35
LMNA P02545 1/20 0.35
RAB9A P51151 1/20 0.35
SIRT2 Q8IXJ6 2/20 0.34
SLC6A1 P30531 2/20 0.33
CACNA1G O43497 1/20 0.33
PTGFR P43088 1/20 0.33
LTA4H P09960 1/20 0.33
UTS2R Q9UKP6 1/20 0.33
SLC6A11 P48066 1/20 0.33
FASN P49327 1/20 0.33
HDAC3 O15379 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
SCHEMBL3511894 0.97 LTA4H (0.36) BCL2CHRM5CHRM1CHRM3ALDH1A1
SCHEMBL3427735 0.90 KIF11 (0.38) CHRM5CHRM1CHRM3ALDH1A1LMNA
SCHEMBL3427733 0.87 NPC1 (0.36) CHRM5CHRM1CHRM3RAB9ASLC6A1
SCHEMBL3428444 0.87 RAB9A (0.38) CHRM5CHRM1CHRM3ALDH1A1L3MBTL1
SCHEMBL3426000 0.87 CHRM5 (0.35) BCL2CHRM5CHRM1CHRM3ALDH1A1
SCHEMBL3425260 0.85 ALDH1A1 (0.47) ALDH1A1LMNA
SCHEMBL3422392 0.85 PREP (0.45) CHRM5CHRM1CHRM3L3MBTL1SIRT2
SCHEMBL3425992 0.84 LTA4H (0.34) BCL2CHRM5CHRM1CHRM3L3MBTL1
SCHEMBL3422388 0.83 PREP (0.46) L3MBTL1SIRT2
SCHEMBL3425256 0.83 ALDH1A1 (0.45) ALDH1A1KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220403377-A1 MODIFIED iRNA AGENTS ALNYLAM PHARMACEUTICALS, INC. 2022-12-22 US disclosed
US-11312957-B2 Modified iRNA agents ALNYLAM PHARMACEUTICALS, INC. (US) 2022-04-26 US disclosed
US-10676740-B2 Modified iRNA agents ALNYLAM PHARMACEUTICALS, INC. (US) 2020-06-09 US disclosed
US-20190345498-A1 MODIFIED iRNA AGENTS BANK OF AMERICA, N.A. 2019-11-14 US disclosed
US-20180258427-A1 MODIFIED iRNA AGENTS BANK OF AMERICA, N.A. 2018-09-13 US disclosed
US-20160264968-A1 MODIFIED iRNA AGENTS ALNYLAM PHARMACEUTICALS, INC. 2016-09-15 US disclosed
US-9394540-B2 Modified iRNA agents ALNYLAM PHARMACEUTICALS, INC. (US) 2016-07-19 US disclosed
US-20140316124-A1 MODIDIFED iRNA AGENTS BANK OF AMERICA, N.A. 2014-10-23 US disclosed
US-8796436-B2 Modified iRNA agents ALNYLAM PHARMACEUTICALS, INC. (US) 2014-08-05 US disclosed
US-20130211063-A1 MODIFIED iRNA AGENTS ALNYLAM PHARMACEUTICALS, INC. (US) 2013-08-15 US disclosed
US-8507661-B2 Modified iRNA agents ALNYLAM PHARMACEUTICALS, INC. (US) 2013-08-13 US disclosed
US-20100292455-A1 MODIFIED iRNA AGENTS ALNYLAM PHARMACEUTICALS (US) 2010-11-18 US disclosed
US-7745608-B2 Modified iRNA agents ALNYLAM PHARMACEUTICALS, INC. (US) 2010-06-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220403377-A1 MODIFIED iRNA AGENTS NCL, HNRNPA0, HNRNPA1 BCL2 2727/4885CHRM5 3938/4885CHRM1 3733/4885
US-20190345498-A1 MODIFIED iRNA AGENTS NCL, HNRNPA0, HNRNPA1 BCL2 2727/4885CHRM5 3938/4885CHRM1 3733/4885
US-20100292455-A1 MODIFIED iRNA AGENTS NCL, HNRNPA0, HNRNPA1 BCL2 2727/4885CHRM5 3938/4885CHRM1 3733/4885
US-20180258427-A1 MODIFIED iRNA AGENTS NCL, HNRNPA0, HNRNPA1 BCL2 2727/4885CHRM5 3938/4885CHRM1 3733/4885
US-10676740-B2 Modified iRNA agents NCL, HNRNPA0, HNRNPA1 BCL2 2727/4885CHRM5 3938/4885CHRM1 3733/4885
US-11312957-B2 Modified iRNA agents NCL, HNRNPA0, HNRNPA1 BCL2 2727/4885CHRM5 3938/4885CHRM1 3733/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.