SCHEMBL4803750

SCHEMBL4803750

CCC1(C)CC(=O)CC(C)(C)N1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
CYP2C19 P33261 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
TSHR P16473 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 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
SCHEMBL9202272 0.89 LMNA (0.44) KDM4ELMNACYP2C19SMN1; SMN2TSHR
SCHEMBL1802571 0.80 HSD17B10 (0.42) KDM4ELMNACYP2C19SMN1; SMN2
SCHEMBL1803803 0.78 KDM4E (0.40) KDM4ELMNACYP2C19SMN1; SMN2TSHR
SCHEMBL38953 0.78 SMN1; SMN2 (0.56) KDM4ELMNACYP2C19SMN1; SMN2TSHR
SCHEMBL1806745 0.77 HSD17B10 (0.37) SMN1; SMN2NPSR1ALDH1A1
Water SCHEMBL7733637 0.76 SMN1; SMN2 (0.54) KDM4ELMNACYP2C19SMN1; SMN2TSHR
SCHEMBL29829697 0.76 SMN1; SMN2 (0.54) KDM4ELMNACYP2C19SMN1; SMN2TSHR
Water SCHEMBL4837114 0.76 SMN1; SMN2 (0.54) KDM4ELMNACYP2C19SMN1; SMN2TSHR
Hydrochloric Acid SCHEMBL20704047 0.76 SMN1; SMN2 (0.54) KDM4ELMNACYP2C19SMN1; SMN2TSHR
Iodide SCHEMBL11830139 0.76 SMN1; SMN2 (0.54) KDM4ELMNACYP2C19SMN1; SMN2TSHR

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-20240025877-A1 PROCESSES FOR MAKING MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED 2024-01-25 US disclosed
US-20210246117-A1 PROCESSES FOR MAKING MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS (SAN DIEGO) LLC 2021-08-12 US disclosed
US-20200369608-A1 PROCESSES FOR PREPARING PYRROLIDINE COMPOUNDS VERTEX PHARMACEUTICALS (SAN DIEGO) LLC 2020-11-26 US disclosed
US-7402639-B2 1-alkoxy-polyalkyl-piperidine derivatives and their use as polymerization regulators CIBA SPECIALTY CHEMICALS CORP. (US) 2008-07-22 US disclosed
US-6927295-B2 A polymerization catalyst for free radical polymerization of ethylenically unsaturated monomers CIBA SPECIALTY CHEMICALS CORP. (US) 2005-08-09 US disclosed
US-20050131177-A1 1-Alkoxy-polyalkyl-piperidine derivatives and their use as polymerization regulators KRAMER ANDREAS (SE) 2005-06-16 US disclosed
US-6683142-B2 PROVIDE POLYMERIC RESIN PRODUCTS HAVING LOW POLYDISPERSITY. CIBA SPECIALTY CHEMICALS CORPORATION 2004-01-27 US disclosed
US-20030220423-A1 1-alkoxy-polyalkyl-piperidine derivatives and their use as polymerization regulators KRAMER ANDREAS (CH) 2003-11-27 US disclosed
US-20020107397-A1 1-alkoxy-polyalkyl-piperidine derivatives and their use as polymerization regulators KRAMER ANDREAS (CH) 2002-08-08 US disclosed
US-6353107-B1 FREE RADICAL CATALYSTS FOR ADDITION POLYMERIZATION; NARROW MOLECULAR WEIGHT DISTRIBUTION; HIGH PURITY AND COLORLESS CIBA SPECIALTY CHEMICALS CORPORATION 2002-03-05 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-20050131177-A1 1-Alkoxy-polyalkyl-piperidine derivatives and their use as polymerization regulators PYM1, PTGER1, CBR1 KDM4E 1318/4885LMNA 213/4885CYP2C19 1143/4885
US-20020107397-A1 1-alkoxy-polyalkyl-piperidine derivatives and their use as polymerization regulators CBR1, PYM1, ELOC KDM4E 2651/4885LMNA 156/4885CYP2C19 1389/4885
US-20210246117-A1 PROCESSES FOR MAKING MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR CFTR, SCNN1B, SCNN1G KDM4E 4286/4885LMNA 3683/4885CYP2C19 3157/4885
US-20200369608-A1 PROCESSES FOR PREPARING PYRROLIDINE COMPOUNDS MTAP, PRMT5, TET3 KDM4E 142/4885LMNA 1837/4885CYP2C19 1241/4885
US-20240025877-A1 PROCESSES FOR MAKING MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR CFTR, SCNN1B, SCNN1G KDM4E 4464/4885LMNA 3445/4885CYP2C19 4040/4885
US-20030220423-A1 1-alkoxy-polyalkyl-piperidine derivatives and their use as polymerization regulators PYM1, ELOC, CBR1 KDM4E 2507/4885LMNA 147/4885CYP2C19 1307/4885

“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.