SCHEMBL13032048

SCHEMBL13032048

CCC(=O)N1CC[C@H](O)[C@@H]1CC

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ EPHX2 P34913 2/20 0.33
▸ GBA1 P04062 1/20 0.33
▸ CHRNB2 P17787 3/20 0.32
▸ CHRNA3 P32297 3/20 0.32
▸ CHRNA4 P43681 3/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ CHRNB3 Q05901 1/20 0.32
▸ CHRNA6 Q15825 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ CHRNB4 P30926 2/20 0.32
▸ CHRNA7 P36544 2/20 0.32
▸ MAPT P10636 1/20 0.31
▸ GBA2 Q9HCG7 2/20 0.31
▸ OPRK1 P41145 2/20 0.30
▸ HCRTR2 O43614 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
SCHEMBL13032108 1.00 MEN1 (0.35) MEN1TSHRHTTKMT2AEPHX2
SCHEMBL13032050 0.87 GBA1 (0.42) MEN1TSHRHTTKMT2AEPHX2
SCHEMBL20470817 0.78 MAPT (0.36) MEN1TSHRHTTKMT2AEPHX2
SCHEMBL4252620 0.77 TSHR (0.38) MEN1TSHRHTTKMT2AEPHX2
SCHEMBL2544915 0.77 TSHR (0.38) MEN1TSHRHTTKMT2AEPHX2
SCHEMBL4254625 0.77 TSHR (0.38) MEN1TSHRHTTKMT2AEPHX2
SCHEMBL4252585 0.77 TSHR (0.38) MEN1TSHRHTTKMT2AEPHX2
SCHEMBL4251812 0.77 TSHR (0.38) MEN1TSHRHTTKMT2AEPHX2
SCHEMBL4251810 0.77 TSHR (0.38) MEN1TSHRHTTKMT2AEPHX2
SCHEMBL24439022 0.74 CHRM2 (0.41) MEN1KMT2ASMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8507661-B2 Modified iRNA agents ALNYLAM PHARMACEUTICALS, INC. (US) 2013-08-13 — — US disclosed
US-8404862-B2 Ligand-conjugated monomers ALNYLAM PHARMACEUTICALS, INC. (US) 2013-03-26 — — US disclosed
US-20100292455-A1 MODIFIED iRNA AGENTS ALNYLAM PHARMACEUTICALS (US) 2010-11-18 — — US disclosed
US-20100267810-A1 METHODS AND COMPOSITIONS FOR TREATING NEUROLOGICAL DISEASE UNIVERSITY OF MASSACHUSETTS (US) 2010-10-21 — — US disclosed
US-7745608-B2 Modified iRNA agents ALNYLAM PHARMACEUTICALS, INC. (US) 2010-06-29 — — US disclosed
US-20100069471-A1 CHEMICALLY MODIFIED OLIGONUCLEOTIDES ALNYLAM PHARMACEUTICALS, INC. (US) 2010-03-18 — — US disclosed
US-20090286973-A1 LIGAND-CONJUGATED MONOMERS ALNYLAM PHARMACEUTICALS, INC. (US) 2009-11-19 — — US disclosed
US-7582744-B2 containing 2'-O-methyl modified nucleoside; oligonucleotide having a nucleotide sequence consisting of from 12 to 23 nucleotides in length sufficiently complementary to a microRNA target sequence of about 12 to 23 nucleotides, conjugate with a cholesterol or steroid; for inhibiting gene expression ALNYLAM PHARMACEUTICALS, INC. (US) 2009-09-01 — — US disclosed
US-20070161591-A1 Methods and compositions for treating neurological disease UNIVERSITY OF MASSACHUSETTS (US) 2007-07-12 — — US disclosed
US-20070105803-A1 Methods and compositions for treating neurological disease MASSACHUSETTS, UNIVERSITY OF 2007-05-10 — — 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-20100069471-A1 CHEMICALLY MODIFIED OLIGONUCLEOTIDES NSUN2, RNGTT, DCLRE1B MEN1 3126/4885TSHR 2656/4885HTT 2695/4885
US-20070161591-A1 Methods and compositions for treating neurological disease SMN1; SMN2, CLN6, INA MEN1 1598/4885TSHR 4453/4885HTT 12/4885
US-20100292455-A1 MODIFIED iRNA AGENTS NCL, HNRNPA0, HNRNPA1 MEN1 630/4885TSHR 2206/4885HTT 1329/4885
US-20100267810-A1 METHODS AND COMPOSITIONS FOR TREATING NEUROLOGICAL DISEASE SMN1; SMN2, CLN6, INA MEN1 1598/4885TSHR 4453/4885HTT 12/4885
US-20070105803-A1 Methods and compositions for treating neurological disease SMN1; SMN2, CLN6, INA MEN1 1598/4885TSHR 4453/4885HTT 12/4885
US-20090286973-A1 LIGAND-CONJUGATED MONOMERS TNFSF11, BCDIN3D, CD40LG MEN1 1993/4885TSHR 1734/4885HTT 2137/4885

“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.

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