SCHEMBL12130554

SCHEMBL12130554

CCCCC(Oc1ccccc1)N1CCCCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.43
SLC6A2 P23975 3/20 0.41
SLC6A3 Q01959 2/20 0.41
SLC6A4 P31645 4/20 0.39
CYP1A2 P05177 3/20 0.39
CYP3A4 P08684 3/20 0.39
CYP2D6 P10635 3/20 0.39
CYP2C19 P33261 3/20 0.39
CYP2C9 P11712 2/20 0.39
KCNA5 P22460 2/20 0.39
KCNH2 Q12809 2/20 0.39
GRIN1 Q05586 1/20 0.39
GRIN2A Q12879 1/20 0.39
GRIN2B Q13224 1/20 0.39
KCNE1 P15382 1/20 0.39
POLB P06746 1/20 0.38
OPRM1 P35372 1/20 0.37
OPRD1 P41143 1/20 0.37
OPRK1 P41145 1/20 0.37
OPRL1 P41146 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
SCHEMBL12130449 1.00 HRH3 (0.43) HRH3SLC6A2SLC6A3SLC6A4CYP1A2
SCHEMBL12130553 0.98 SLC6A2 (0.42) HRH3SLC6A2SLC6A3SLC6A4CYP1A2
SCHEMBL12130611 0.93 LTA4H (0.47) HRH3SLC6A2SLC6A3SLC6A4GRIN1
SCHEMBL12130604 0.90 HRH3 (0.46) HRH3SLC6A2SLC6A3KCNH2LTA4H
SCHEMBL12130576 0.89 SLC6A3 (0.48) SLC6A2SLC6A3SLC6A4CYP1A2CYP3A4
SCHEMBL12130605 0.86 LTA4H (0.45) HRH3SLC6A2SLC6A3LTA4H
SCHEMBL12130555 0.85 LMNA (0.44) HRH3CYP1A2KCNA5KCNH2TSHR
SCHEMBL12130507 0.85 HRH3 (0.52) HRH3SLC6A2SLC6A3SLC6A4TSHR
SCHEMBL12130583 0.85 SLC6A4 (0.50) HRH3SLC6A2SLC6A3SLC6A4GRIN1
SCHEMBL12821114 0.85 SLC6A2 (0.49) HRH3SLC6A2SLC6A3SLC6A4

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 2 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

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 1/4885SLC6A2 941/4885SLC6A3 2035/4885

“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.