SCHEMBL10109312

SCHEMBL10109312

CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)cn2C(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 5/20 0.56
HTR1D P28221 4/20 0.56
HTR1B P28222 4/20 0.56
HTR1F P30939 3/20 0.56
HTR7 P34969 3/20 0.56
HTR2A P28223 2/20 0.56
HTR1E P28566 2/20 0.56
HTR2B P41595 2/20 0.56
HTR2C P28335 1/20 0.56
HTR3A P46098 1/20 0.56
HTR5A P47898 1/20 0.56
SLC47A1 Q96FL8 1/20 0.56
HTR6 P50406 17/20 0.40
DRD2 P14416 2/20 0.39
DRD3 P35462 2/20 0.39
LMNA P02545 1/20 0.39
ADRA2B P18089 1/20 0.39
KCNH2 Q12809 1/20 0.39

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
SCHEMBL9688466 0.85 HTR1A (0.60) HTR1AHTR1DHTR1BHTR1FHTR7
SCHEMBL9687324 0.83 HTR1A (0.57) HTR1AHTR1DHTR1BHTR1FHTR7
SCHEMBL13651695 0.82 HTR1A (0.56) HTR1AHTR1DHTR1BHTR1FHTR7
Hydrochloric Acid SCHEMBL9687692 0.82 HTR1A (0.56) HTR1AHTR1DHTR1BHTR1FHTR7
SCHEMBL10108909 0.82 HTR1A (0.60) HTR1AHTR1DHTR1BHTR1FHTR7
SCHEMBL9597932 0.81 HTR1A (0.55) HTR1AHTR1DHTR1BHTR1FHTR7
SCHEMBL9687900 0.81 HTR1A (0.55) HTR1AHTR1DHTR1BHTR1FHTR7
SCHEMBL9597530 0.80 HTR1A (0.53) HTR1AHTR1DHTR1BHTR1FHTR7
SCHEMBL9765127 0.80 HTR6 (0.61) HTR1AHTR1DHTR1BHTR1FHTR7
Oxalic Acid SCHEMBL9597338 0.77 HTR1A (0.51) HTR1AHTR1DHTR1BHTR1FHTR7

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-8101782-B2 Drug hybrid of rivastigmine or physostigmine with tranylcypromine, amoxapine, desipramine, nortriptyline, protriptyline, fluoxetine, fluvoxamine, paroxetine, duloxetine, betahistine, amlodipine, proylhexedrine, rimantadine, desloratadine; Alzheimer's disease; Parkinson's disease, impairment in memory COLUCID PHARMACEUTICALS, INC. (US) 2012-01-24 US disclosed
US-20080261950-A1 Compounds that inhibit cholinesterase COLUCID PHARMACEUTICALS, INC. (US) 2008-10-23 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-20080261950-A1 Compounds that inhibit cholinesterase ACHE, BCHE, CHAT HTR1A 1027/4885HTR1D 1726/4885HTR1B 799/4885

“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.