SCHEMBL6776793

SCHEMBL6776793

O=C1CCCN1C1CC(CCN2CCCC2)=NO1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 2/20 0.49
LTA4H P09960 2/20 0.31
KCNH2 Q12809 2/20 0.31
CYP1A2 P05177 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CHRM3 P20309 1/20 0.31
CYP2C19 P33261 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
KMT2A Q03164 1/20 0.30

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
SCHEMBL6778182 0.99 CHRM1 (0.48) CHRM1LTA4HKCNH2CYP1A2CHRM2
SCHEMBL6777537 0.86 CHRM1 (0.45) CHRM1LTA4HCYP1A2CHRM2CHRM4
SCHEMBL6782856 0.85 CHRM1 (0.44) CHRM1LTA4HCYP1A2CHRM2CHRM4
SCHEMBL6779493 0.76 ADRA1A (0.48) CHRM1CYP1A2CHRM2CHRM4CHRM5
SCHEMBL13170185 0.72 CHRM1 (0.53) CHRM1
SCHEMBL6779518 0.66 CHRM1 (1.00) CHRM1CHRM2CHRM4CHRM5CHRM3
Pyrrolidine SCHEMBL7083927 0.66 CHRM1 (0.47) CHRM1
SCHEMBL6777276 0.65 CHRM1 (0.49) CHRM1
Piperidine SCHEMBL7088590 0.65 CHRM1 (0.46) CHRM1
SCHEMBL31103576 0.64 CHRM1 (0.54) CHRM1

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 1/4885LTA4H 1633/4885KCNH2 1084/4885

“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.