SCHEMBL2248354

SCHEMBL2248354

OB(O)c1cccc(CN2CCCCC2)c1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.63
ALDH1A1 P00352 3/20 0.63
TDP1 Q9NUW8 1/20 0.58
CYP2D6 P10635 2/20 0.56
CYP2C9 P11712 1/20 0.56
HIF1A Q16665 1/20 0.56
PRMT6 Q96LA8 1/20 0.56
KDM4E B2RXH2 1/20 0.54
GAA P10253 1/20 0.54
ENPP2 Q13822 2/20 0.53
HRH3 Q9Y5N1 3/20 0.50
CYP2C19 P33261 1/20 0.50
POLB P06746 1/20 0.47
HTT P42858 1/20 0.47

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
SCHEMBL29955283 1.00 SMN1; SMN2 (0.63) SMN1; SMN2ALDH1A1TDP1CYP2D6CYP2C9
Hydrochloric Acid SCHEMBL2279012 0.98 SMN1; SMN2 (0.61) SMN1; SMN2ALDH1A1TDP1CYP2D6CYP2C9
Hydrochloric Acid SCHEMBL29950873 0.98 SMN1; SMN2 (0.61) SMN1; SMN2ALDH1A1TDP1CYP2D6CYP2C9
SCHEMBL1724355 0.98 SMN1; SMN2 (0.60) SMN1; SMN2ALDH1A1TDP1CYP2D6CYP2C9
Hydrochloric Acid SCHEMBL29955383 0.97 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1TDP1CYP2D6CYP2C9
SCHEMBL16633728 0.86 L3MBTL3 (0.64) SMN1; SMN2ALDH1A1TDP1CYP2D6CYP2C9
SCHEMBL2561398 0.85 NCF1 (0.55) SMN1; SMN2ALDH1A1TDP1PRMT6KDM4E
SCHEMBL3666137 0.84 MC4R (0.57) SMN1; SMN2ALDH1A1PRMT6KDM4EENPP2
SCHEMBL875822 0.84 NCF1 (0.60) SMN1; SMN2ALDH1A1KDM4EENPP2HRH3
Hydrochloric Acid SCHEMBL29952963 0.83 NCF1 (0.59) SMN1; SMN2ALDH1A1KDM4EENPP2HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230322689-A1 IONIZABLE LIPID COMPOUNDS AND LIPID NANOPARTICLE COMPOSITIONS SunVax mRNA Therapeutics Inc. (US) 2023-10-12 US disclosed
US-20230322689-A1 IONIZABLE LIPID COMPOUNDS AND LIPID NANOPARTICLE COMPOSITIONS SunVax mRNA Therapeutics Inc. (US) 2023-10-12 US disclosed
US-8207162-B2 Chiral fused [1,2]imidazo[4,5-c] ring compounds 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-06-26 US disclosed
US-8084449-B2 Dual pharmacophores—PDE4-muscarinic antagonistics GLAXO GROUP LIMITED (GB) 2011-12-27 US disclosed
US-8067408-B2 Dual pharmacophores—PDE4-muscarinic antagonistics GLAXO GROUP LIMITED (GB) 2011-11-29 US disclosed
US-20110207725-A1 CHIRAL FUSED [1,2]IMIDAZO[4,5-c] RING COMPOUNDS 3M INNOVATIVE PROPERTIES COMPANY 2011-08-25 US disclosed
US-7601725-B2 Thienopyrimidines useful as Aurora kinase inhibitors SUNESIS PHARMACEUTICALS, INC. (US) 2009-10-13 US disclosed
US-20090203657-A1 Dual Pharmacophores - PDE4-Muscarinic Antagonistics GLAXO GROUP LIMITED (GB) 2009-08-13 US disclosed
US-20090197871-A1 Dual Pharmacophores - PDE4-Muscarinic Antagonistics GLAXO GROUP LIMITED (GB) 2009-08-06 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 (4 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-20090203657-A1 Dual Pharmacophores - PDE4-Muscarinic Antagonistics PDE4A, PDE1A, PDE4B SMN1; SMN2 2601/4885ALDH1A1 826/4885TDP1 1136/4885
US-20110207725-A1 CHIRAL FUSED [1,2]IMIDAZO[4,5-c] RING COMPOUNDS IFNAR1, IFNG, IL4 SMN1; SMN2 2992/4885ALDH1A1 1323/4885TDP1 3801/4885
US-20090197871-A1 Dual Pharmacophores - PDE4-Muscarinic Antagonistics PDE4B, PDE4A, CHRM4 SMN1; SMN2 4271/4885ALDH1A1 1389/4885TDP1 2097/4885
US-20230322689-A1 IONIZABLE LIPID COMPOUNDS AND LIPID NANOPARTICLE COMPOSITIONS PHOSPHO1, SGMS1, PLIN3 SMN1; SMN2 3781/4885ALDH1A1 3500/4885TDP1 4529/4885

“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.