SCHEMBL6782856

SCHEMBL6782856

O=C1CCCN1C1CC(CN2CCCCC2)=NO1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 2/20 0.44
ADRA1D P25100 1/20 0.37
ADRA1A P35348 1/20 0.37
HRH3 Q9Y5N1 1/20 0.34
KMT2A Q03164 2/20 0.33
CYP1A2 P05177 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CHRM3 P20309 1/20 0.32
CYP2C19 P33261 1/20 0.32
LTA4H P09960 1/20 0.31

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
SCHEMBL6777537 0.99 CHRM1 (0.45) CHRM1ADRA1DADRA1AHRH3KMT2A
SCHEMBL6778182 0.86 CHRM1 (0.48) CHRM1HRH3KMT2ACYP1A2CHRM2
SCHEMBL6776793 0.85 CHRM1 (0.49) CHRM1HRH3KMT2ACYP1A2CHRM2
SCHEMBL6777739 0.74 ADRA1D (0.59) CHRM1ADRA1DADRA1AHRH3KMT2A
SCHEMBL13170185 0.73 CHRM1 (0.53) CHRM1
Piperidine SCHEMBL7088590 0.69 CHRM1 (0.46) CHRM1
Pyrrolidine SCHEMBL7083927 0.67 CHRM1 (0.47) CHRM1
SCHEMBL31103576 0.65 CHRM1 (0.54) CHRM1
SCHEMBL28062125 0.65 CHRM1 (0.54) CHRM1KMT2A
SCHEMBL8831896 0.64

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-6759419-B2 NOOTROPIC AGENTS; BRAIN DISORDERS; ALZHEIMER'S DISEASE KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2004-07-06 US claimed
US-20030114491-A1 Pyrrolidinone derivatives, their preparation and pharmaceutical composition comprising the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2003-06-19 US claimed
US-6759419-B2 NOOTROPIC AGENTS; BRAIN DISORDERS; ALZHEIMER'S DISEASE KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2004-07-06 US disclosed
US-20030114491-A1 Pyrrolidinone derivatives, their preparation and pharmaceutical composition comprising the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2003-06-19 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-20030114491-A1 Pyrrolidinone derivatives, their preparation and pharmaceutical composition comprising the same CHRM1, CHRNA5, CHRNA7 CHRM1 1/4885ADRA1D 26/4885ADRA1A 24/4885

“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.