SCHEMBL992649

SCHEMBL992649

CCCCC(Oc1ccc(Cl)cc1)N1CCCC1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 9/20 0.40
SLC6A4 P31645 3/20 0.40
SIGMAR1 Q99720 5/20 0.39
TSHR P16473 1/20 0.39
SLC6A2 P23975 2/20 0.37
SLC6A3 Q01959 2/20 0.37
TP53 P04637 1/20 0.37
PPARA Q07869 1/20 0.37

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
SCHEMBL12130583 0.87 SLC6A4 (0.50) HRH3SLC6A4TSHRSLC6A2SLC6A3
SCHEMBL12130507 0.87 HRH3 (0.52) HRH3SLC6A4TSHRSLC6A2SLC6A3
SCHEMBL994382 0.85 SLC6A2 (0.45) HRH3SLC6A4TSHRSLC6A2SLC6A3
SCHEMBL12130610 0.85 SLC6A3 (0.45) HRH3SLC6A4TSHRSLC6A2SLC6A3
SCHEMBL12130553 0.85 SLC6A2 (0.42) HRH3SLC6A4SLC6A2SLC6A3
SCHEMBL12130449 0.84 HRH3 (0.43) HRH3SLC6A4TSHRSLC6A2SLC6A3
SCHEMBL12130554 0.84 HRH3 (0.43) HRH3SLC6A4TSHRSLC6A2SLC6A3
SCHEMBL12130459 0.83 HRH3 (0.43) HRH3SLC6A4SLC6A2SLC6A3
SCHEMBL12130611 0.83 LTA4H (0.47) HRH3SLC6A4SLC6A2SLC6A3
SCHEMBL12130604 0.83 HRH3 (0.46) HRH3SLC6A2SLC6A3PPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110281844-A1 NON-IMIDAZOLE ALKYLAMINES AS HISTAMINE H3-RECEPTOR LIGANDS AND THEIR THERAPEUTIC APPLICATIONS SCHWARTZ JEAN-CHARLES (FR) 2011-11-17 US disclosed
US-7910605-B2 Non-imidazole alkylamines as histamine H3- receptor ligands and their therapeutic applications SOCIETE CIVILE BIOPROJET (FR) 2011-03-22 US disclosed
WO-2011008666-A2 3-PHENOXYMETHYLPYRROLIDINE COMPOUNDS THERAVANCE, INC. (US) 2011-01-20 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 (1 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-20110281844-A1 NON-IMIDAZOLE ALKYLAMINES AS HISTAMINE H3-RECEPTOR LIGANDS AND THEIR THERAPEUTIC APPLICATIONS HRH3, HRH4, HRH2 HRH3 1/4885SLC6A4 1647/4885SIGMAR1 17/4885

“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.