SCHEMBL1335893

SCHEMBL1335893

C[C@H]1C[C@H](C)CN(C(CCCc2ccc(Cl)cc2)CCOCCC(CCCc2ccc(Cl)cc2)N2C[C@@H](C)C[C@H](C)C2)C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HRH3 Q9Y5N1 6/20 0.41
SLC6A2 P23975 2/20 0.41
HRH1 P35367 2/20 0.41
CHRM2 P08172 1/20 0.41
ADRA2C P18825 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
KCNH2 Q12809 1/20 0.41
CACNA1C Q13936 1/20 0.41
SCN5A Q14524 1/20 0.41
SIGMAR1 Q99720 6/20 0.40
CHRM4 P08173 1/20 0.40
HTR2C P28335 1/20 0.40
HTR7 P34969 1/20 0.40
TMEM97 Q5BJF2 1/20 0.40
HRH4 Q9H3N8 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36

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
SCHEMBL1335891 1.00 SMN1; SMN2 (0.41) SMN1; SMN2L3MBTL1HRH3SLC6A2HRH1
SCHEMBL6052744 0.93 SIGMAR1 (0.44) SMN1; SMN2L3MBTL1HRH3SLC6A2HRH1
SCHEMBL5713432 0.87 SIGMAR1 (0.42) SMN1; SMN2HRH3SIGMAR1MEN1KMT2A
SCHEMBL5713501 0.87 SIGMAR1 (0.42) SMN1; SMN2HRH3SIGMAR1MEN1KMT2A
SCHEMBL491563 0.80 HRH3 (0.57) HRH3SLC6A2HRH1CHRM2ADRA2C
SCHEMBL491873 0.76 HRH3 (0.63) SMN1; SMN2L3MBTL1HRH3SLC6A2HRH1
SCHEMBL491585 0.76 HRH3 (0.63) SMN1; SMN2L3MBTL1HRH3SLC6A2HRH1
SCHEMBL491900 0.76 HRH3 (0.63) SMN1; SMN2L3MBTL1HRH3SLC6A2HRH1
SCHEMBL5713440 0.73 SIGMAR1 (0.50) HRH3SIGMAR1HTR2CMEN1KMT2A
SCHEMBL5713495 0.72 HPGD (0.45) SMN1; SMN2L3MBTL1HRH3SIGMAR1HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1707203-A1 Treatment of parkinson's disease obstructive sleep apnea, dementia with lewy bodies, vascular dementia with non-imidazole alkylamines histamine H3- receptor ligands BIOPROJET (FR) 2006-10-04 EP claimed
EP-1707204-A1 Treatment of epilepsy with non-imidazole alkylamines histamine H3-receptor ligands BIOPROJET (FR) 2006-10-04 EP claimed
US-8486947-B2 Treatment of Parkinson's disease, obstructive sleep apnea, dementia with Lewy bodies, vascular dementia with non-imidazole alkylamines histamine H3-receptor ligands BIOPROJET (FR) 2013-07-16 US disclosed
US-20110281844-A1 NON-IMIDAZOLE ALKYLAMINES AS HISTAMINE H3-RECEPTOR LIGANDS AND THEIR THERAPEUTIC APPLICATIONS SCHWARTZ JEAN-CHARLES (FR) 2011-11-17 US disclosed
EP-1641461-B1 COMBINATION PRODUCT COMPRISING AN ANTAGONIST OR INVERSE AGONIST OF HISTAMINE RECEPTOR H<SB>3</SB> AND AN ANTIPSYCHOTIC OR ANTIDEPRESSANT AGENT, AND USE THEREOF FOR THE PREPARATION OF A MEDICAMENT THAT PREVENTS THE ADVERSE EFFECTS OF PSYCHOTROPIC DRUGS BIOPROJET SOC CIV (FR) 2010-09-29 EP disclosed
US-20090318433-A1 VERY FAST TIME RESOLVED IMAGING IN MULTIPARAMETER MEASUREMENT SPACE BIOPROJET (FR) 2009-12-24 US disclosed
EP-2000462-A2 Non-imidazole alkylamines as histamine H3-receptor ligands and their therapeutic applications BIOPROJET (FR) 2008-12-10 EP disclosed
US-7169928-B2 central nervous system disorders; Alzheimer's disease; attention deficit disorders; cognition activators; psychological disorders; antidepressants SOCIETE CIVILE BIOPROJECT (FR) 2007-01-30 US disclosed
US-20060247223-A1 Administering tertiary amines, e.g., 3,3-Dimethylbutyl 3-piperidinopropyl ether, 3-Phenylpropyl 3-piperidinopropyl ether, or3-(4-Chlorophenyl)propyl 3-piperidinopropyl ether to treat cognitive disorders such as attention, wakefulness and memory disorders SCHWARTZ JEAN-CHARLES 2006-11-02 US disclosed
EP-1707204-A1 Treatment of epilepsy with non-imidazole alkylamines histamine H3-receptor ligands BIOPROJET (FR) 2006-10-04 EP disclosed
EP-1707203-A1 Treatment of parkinson's disease obstructive sleep apnea, dementia with lewy bodies, vascular dementia with non-imidazole alkylamines histamine H3- receptor ligands BIOPROJET (FR) 2006-10-04 EP disclosed
US-20040220225-A1 central nervous system disorders; Alzheimer's disease; attention deficit disorders; cognition activators; psychological disorders; antidepressants SCHWARTZ JEAN-CHARLES (FR) 2004-11-04 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-20090318433-A1 VERY FAST TIME RESOLVED IMAGING IN MULTIPARAMETER MEASUREMENT SPACE HRH3, HRH4, HCRTR2 SMN1; SMN2 641/4885L3MBTL1 834/4885HRH3 1/4885
US-20060247223-A1 Administering tertiary amines, e.g., 3,3-Dimethylbutyl 3-piperidinopropyl ether, 3-Phenylpropyl 3-piperidinopropyl ether, or3-(4-Chlorophenyl)propyl 3-piperidinopropyl ether to treat cognitive disorders such as attention, wakefulness and memory disorders HRH3, HRH4, PNMT SMN1; SMN2 1979/4885L3MBTL1 825/4885HRH3 1/4885
US-20040220225-A1 central nervous system disorders; Alzheimer's disease; attention deficit disorders; cognition activators; psychological disorders; antidepressants HTR1A, HRH4, HTR1D SMN1; SMN2 730/4885L3MBTL1 1621/4885HRH3 6/4885
US-20110281844-A1 NON-IMIDAZOLE ALKYLAMINES AS HISTAMINE H3-RECEPTOR LIGANDS AND THEIR THERAPEUTIC APPLICATIONS HRH3, HRH4, HRH2 SMN1; SMN2 3925/4885L3MBTL1 1955/4885HRH3 1/4885

“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.