SCHEMBL6370221

SCHEMBL6370221

O=C(c1ccccc1Sc1ccccn1)N1CCN2CCC1CC2

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.43
HTR3A P46098 1/20 0.41
HCRTR2 O43614 2/20 0.39
CHRNA3 P32297 1/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL6364902 0.82 CHRNA7 (0.44) CHRNA7HTR3ACHRNA3LMNA
SCHEMBL3984845 0.79 L3MBTL1 (0.55) CHRNA7HTR3ACHRNA3
SCHEMBL8635649 0.77 PREP (0.45) HCRTR2MEN1LMNAKMT2A
SCHEMBL8636150 0.77 ABL1 (0.43) HCRTR2LMNA
SCHEMBL6370229 0.71 CHRNA7 (0.43) CHRNA7HTR3AHCRTR2CHRNA3
SCHEMBL4628032 0.71 POLB (0.53) MEN1LMNAKMT2A
SCHEMBL4702959 0.70 SLC6A7 (0.54) CHRNA7HTR3A
SCHEMBL27271667 0.70 ALDH1A1 (0.50) MEN1LMNAKMT2A
SCHEMBL4408507 0.69 MAP2K1 (0.50) CHRNA7HTR3AHCRTR2
SCHEMBL4700028 0.69 GHSR (0.46) CHRNA7HTR3ACHRNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050239774-A1 Biaryl diazabicycloalkane amides as nicotinic acetylcholine agonists ASTRAZENECA AB (SE) 2005-10-27 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-20050239774-A1 Biaryl diazabicycloalkane amides as nicotinic acetylcholine agonists CHRNA1, CHRNB1, CHRNA2 CHRNA7 6/4885HTR3A 162/4885HCRTR2 184/4885

“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.