SCHEMBL3548921

SCHEMBL3548921

N[C@H]1CCN2CCC[C@@H]1C2

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CHRNA7 P36544 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.32
▸ PSMB1 P20618 1/20 0.32
▸ PSMB8 P28062 1/20 0.32
▸ PSMB9 P28065 1/20 0.32
▸ PSMB5 P28074 1/20 0.32
▸ PSMB10 P40306 1/20 0.32
▸ PSMB2 P49721 1/20 0.32
▸ CHRM2 P08172 1/20 0.31
▸ CHRM4 P08173 1/20 0.31
▸ CHRM5 P08912 1/20 0.31
▸ CHRM1 P11229 1/20 0.31
▸ CHRM3 P20309 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
SCHEMBL2317693 1.00 CHRNA7 (0.52) CHRNA7ALDH1A1PSMB1PSMB8PSMB9
Hydrochloric Acid SCHEMBL10568351 0.98 CHRNA7 (0.50) CHRNA7ALDH1A1PSMB1PSMB8PSMB9
SCHEMBL2086631 0.98 CHRNA7 (0.50) CHRNA7ALDH1A1PSMB1PSMB8PSMB9
SCHEMBL4758959 0.98 CHRNA7 (0.50) CHRNA7ALDH1A1PSMB1PSMB8PSMB9
SCHEMBL4757799 0.98 CHRNA7 (0.50) CHRNA7ALDH1A1PSMB1PSMB8PSMB9
Hydrochloric Acid SCHEMBL26112499 0.85 CHRNA7 (0.64) CHRNA7ALDH1A1CHRM2CHRM4CHRM5
SCHEMBL9091935 0.83 — —
SCHEMBL16042687 0.81 CHRNA7 (0.81) CHRNA7ALDH1A1CHRM2CHRM4CHRM5
SCHEMBL843660 0.72 — —
SCHEMBL6099669 0.72 — —

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-7713977-B2 Drug for psychological and central nervous system disorders NOVARTIS AG (CH) 2010-05-11 — — US disclosed
US-20080262030-A1 Drug for psychological and central nervous system disorders NOVARTIS AG (CH) 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-20080262030-A1 Drug for psychological and central nervous system disorders CNR1, CNR2, SLC6A2 CHRNA7 36/4885ALDH1A1 2084/4885PSMB1 1777/4885

“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.

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