SCHEMBL546676

SCHEMBL546676

CCC[C@H](N)C(=O)N(O)C(=O)Nc1n[c]nc2nc[nH]c12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ BRD4 O60885 3/20 0.32
▸ TP53 P04637 2/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ TSHR P16473 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ HIF1A Q16665 1/20 0.32
▸ AURKA O14965 1/20 0.31
▸ DAPK3 O43293 1/20 0.31
▸ JAK2 O60674 1/20 0.31
▸ PRKD3 O94806 1/20 0.31
▸ MAP4K4 O95819 1/20 0.31
▸ PAK4 O96013 1/20 0.31
▸ ABL1 P00519 1/20 0.31
▸ NTRK1 P04629 1/20 0.31
▸ LCK P06239 1/20 0.31
▸ FYN P06241 1/20 0.31
▸ CSF1R P07333 1/20 0.31
▸ RET P07949 1/20 0.31

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
SCHEMBL17372617 0.85 SMN1; SMN2 (0.48) SMN1; SMN2BRD4TP53HSD17B10TSHR
SCHEMBL17372406 0.81 CYP1A2 (0.49) SMN1; SMN2BRD4TP53HSD17B10TSHR
SCHEMBL2346676 0.71 MKNK1 (0.41) SMN1; SMN2BRD4TP53HSD17B10TSHR
SCHEMBL5566830 0.69 SMN1; SMN2 (0.38) SMN1; SMN2BRD4TP53HSD17B10TSHR
SCHEMBL546926 0.68 NPC1 (0.37) SMN1; SMN2BRD4TP53HSD17B10TSHR
SCHEMBL545883 0.67 NPC1 (0.38) SMN1; SMN2BRD4TP53HSD17B10TSHR
SCHEMBL17260458 0.66 SYK (0.47) SMN1; SMN2BRD4TP53HSD17B10TSHR
SCHEMBL7264355 0.64 BRD4 (0.67) BRD4HTTAURKABTK
SCHEMBL5860314 0.62 POLB (0.45) SMN1; SMN2BRD4TP53HSD17B10TSHR
SCHEMBL5858886 0.62 BRD4 (0.42) SMN1; SMN2BRD4HSD17B10BRAF

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 128 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070179100-A1 Protected monomers ALNYLAM PHARMACEUTICALS, INC. 2007-08-02 — — US claimed
EP-1625138-A2 PROTECTED MONOMERS Alnylam Pharmaceuticals Inc. (US) 2006-02-15 — — EP claimed
WO-2004094345-A2 PROTECTED MONOMERS ALNYLAM PHARMACEUTICALS INC. (US) 2004-11-04 — — WO claimed
US-20220403377-A1 MODIFIED iRNA AGENTS ALNYLAM PHARMACEUTICALS, INC. 2022-12-22 — — US disclosed
US-11530408-B2 Therapeutic compositions ALNYLAM PHARMACEUTICALS, INC. (US) 2022-12-20 — — US disclosed
US-20210254065-A1 iRNA AGENTS WITH BIOCLEAVABLE TETHERS ALNYLAM PHARMACEUTICALS, INC. 2021-08-19 — — US disclosed
US-20210177757-A1 EXOSOMES FOR DELIVERY OF THERAPEUTIC AGENTS PURETECH LYT, INC. (US) 2021-06-17 — — US disclosed
US-11015194-B2 iRNA agents with biocleavable tethers ALNYLAM PHARMACEUTICALS, INC. (US) 2021-05-25 — — US disclosed
US-20200255833-A1 THERAPEUTIC COMPOSITIONS BANK OF AMERICA, N.A. 2020-08-13 — — US disclosed
US-10676740-B2 Modified iRNA agents ALNYLAM PHARMACEUTICALS, INC. (US) 2020-06-09 — — US disclosed
US-10669544-B2 Therapeutic compositions ALNYLAM PHARMACEUTICALS, INC. (US) 2020-06-02 — — US disclosed
US-20050164235-A1 Conjugated lipophilic group with a modified nucleotide is used to target disease gene, cells, tissue; drug delivery to entrance into tumor cells; ribose sugar of nucleotide is replaced with a cyclic carrier which has at least one attached phosphate or phosphorothioate group; biodrugs for hepatitis virus ALNYLAM PHARMACEUTICALS, INC. 2005-07-28 — — US disclosed
US-20050153337-A1 iRNA conjugates ALNYLAM PHARMACEUTICALS, INC. 2005-07-14 — — US disclosed
US-20050119214-A1 Nuclease resistant double-stranded ribonucleic acid ALNYLAM PHARMACEUTICALS, INC. 2005-06-02 — — US disclosed
US-20050107325-A1 Conjugated lipophilic group with a modified nucleotide is used to target disease gene, cells, tissue, for drug delivery to entrance into tumor cells; ribose sugar of nucleotide is replaced with a cyclic carrier which has at least one attached phosphate or phosphorothioate group; antitumor biodrugs ALNYLAM PHARMACEUTICALS, INC. 2005-05-19 — — US disclosed
WO-2005004794-A2 METHOD OF TREATING NEURODEGENERATIVE DISEASE ALNYLAM PHARMACEUTICALS INC. (US) 2005-01-20 — — WO disclosed
WO-2004094595-A2 MODIFIED iRNA AGENTS ALNYLAM PHARMACEUTICALS INC. (US) 2004-11-04 — — WO disclosed
WO-2004094345-A2 PROTECTED MONOMERS ALNYLAM PHARMACEUTICALS INC. (US) 2004-11-04 — — WO disclosed
WO-2004091515-A2 iRNA CONJUGATES ALNYLAM PHARMACEUTICALS, INC. (US) 2004-10-28 — — WO disclosed
WO-2004080406-A2 THERAPEUTIC COMPOSITIONS ALNYLAM PHARMACEUTICALS (US) 2004-09-23 — — WO 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 (11 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-20050153337-A1 iRNA conjugates AGO2, NSUN3, RNASE1 SMN1; SMN2 1418/4885BRD4 2344/4885TP53 707/4885
US-20220403377-A1 MODIFIED iRNA AGENTS NCL, HNRNPA0, HNRNPA1 SMN1; SMN2 2665/4885BRD4 2420/4885TP53 1516/4885
US-20210177757-A1 EXOSOMES FOR DELIVERY OF THERAPEUTIC AGENTS EXOSC5, EXOSC9, EXOSC10 SMN1; SMN2 715/4885BRD4 1458/4885TP53 171/4885
US-20050119214-A1 Nuclease resistant double-stranded ribonucleic acid RNASE1, RNASEH1, RNASEL SMN1; SMN2 688/4885BRD4 2426/4885TP53 180/4885
US-20200255833-A1 THERAPEUTIC COMPOSITIONS SNRPE, HNRNPH3, RNASE1 SMN1; SMN2 179/4885BRD4 2399/4885TP53 42/4885
US-10676740-B2 Modified iRNA agents NCL, HNRNPA0, HNRNPA1 SMN1; SMN2 2665/4885BRD4 2420/4885TP53 1516/4885
US-11530408-B2 Therapeutic compositions SNRPE, HNRNPH3, RNASE1 SMN1; SMN2 179/4885BRD4 2399/4885TP53 42/4885
US-10669544-B2 Therapeutic compositions SNRPE, HNRNPH3, RNASE1 SMN1; SMN2 179/4885BRD4 2399/4885TP53 42/4885
US-20050107325-A1 Conjugated lipophilic group with a modified nucleotide is used to target disease gene, cells, tissue, for drug delivery to entrance into tumor cells; ribose sugar of nucleotide is replaced with a cyclic carrier which has at least one attached phosphate or phosphorothioate group; antitumor biodrugs LDLR, SLC29A1, SLC29A2 SMN1; SMN2 2749/4885BRD4 3742/4885TP53 1234/4885
US-20050164235-A1 Conjugated lipophilic group with a modified nucleotide is used to target disease gene, cells, tissue; drug delivery to entrance into tumor cells; ribose sugar of nucleotide is replaced with a cyclic carrier which has at least one attached phosphate or phosphorothioate group; biodrugs for hepatitis virus HAVCR2, LDLR, RNASE1 SMN1; SMN2 3753/4885BRD4 3730/4885TP53 1008/4885
US-20070179100-A1 Protected monomers PCNA, POLN, PARP1 SMN1; SMN2 700/4885BRD4 2420/4885TP53 650/4885

“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.

Send feedback