SCHEMBL13860740

SCHEMBL13860740

CC(C)N1CCC(N2CC(N(C)C)C2)CC1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.33
L3MBTL3 Q96JM7 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL22456351 0.89 L3MBTL3 (0.34) HRH3L3MBTL3L3MBTL1
SCHEMBL26170660 0.85 HRH3 (0.31) HRH3
SCHEMBL22456352 0.85 L3MBTL3 (0.42) HRH3L3MBTL3L3MBTL1
SCHEMBL24854441 0.82
SCHEMBL803511 0.79 L3MBTL3 (0.38) HRH3L3MBTL3L3MBTL1
SCHEMBL20976850 0.78 HRH3 (0.33) HRH3L3MBTL3L3MBTL1
SCHEMBL13861719 0.78 ALDH1A1 (0.41) L3MBTL3L3MBTL1
SCHEMBL12026443 0.76 HRH3 (0.34) HRH3
SCHEMBL24940936 0.76 L3MBTL3 (0.34) L3MBTL3L3MBTL1
SCHEMBL23594125 0.76 OPRM1 (0.34) HRH3L3MBTL3L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8759530-B2 Method for producing phenoxypyridine derivative EISAI R&D MANAGEMENT CO., LTD. (JP) 2014-06-24 US disclosed
US-20140011999-A1 Method for Producing Phenoxypyridine Derivative EISAI R&D MANAGEMENT CO., LTD. (JP) 2014-01-09 US disclosed
US-7531532-B2 Hepatocyte growth factor receptor inhibitors; Antitumor agents, anticarcinogenic agents, angiogenesis inhibitors; pyrimidine derivatives like Pyrrolidine-1-carboxylic acid [6-(2-fluoro-4-{3-[2-(4-fluorophenyl)acetyl]thioureido}phenoxy)pyrimidin-4-yl]amide EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-05-12 US disclosed
US-20070270421-A1 Novel pyridine Derivative and Pyrimidine Derivative (1) EISAI R&D MANAGEMENT CO., LTD. (JP) 2007-11-22 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 (2 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-20070270421-A1 Novel pyridine Derivative and Pyrimidine Derivative (1) HGF, MET, FLT1 HRH3 59/4885L3MBTL3 1125/4885L3MBTL1 1054/4885
US-20140011999-A1 Method for Producing Phenoxypyridine Derivative QDPR, DRD4, DOT1L HRH3 60/4885L3MBTL3 3512/4885L3MBTL1 3547/4885

“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.