SCHEMBL24466889

SCHEMBL24466889

Cc1cc(OCC2CCCN2C)no1

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CHRNB1 P11230 1/20 0.53
▸ CHRNB2 P17787 1/20 0.53
▸ CHRNB4 P30926 1/20 0.53
▸ CHRNA3 P32297 1/20 0.53
▸ CHRNA4 P43681 1/20 0.53
▸ CHRNB3 Q05901 1/20 0.53

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
SCHEMBL29770146 0.92 CHRNA3 (0.45) CHRNB4CHRNA3
SCHEMBL428188 0.75 CHRNB2 (0.56) CHRNB1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL24467086 0.74 NOS1 (0.45) CHRNB1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL29697723 0.71 CHRNB4 (0.63) CHRNB1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL7373184 0.71 CHRNB2 (0.64) CHRNB1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL8441392 0.70 CHRNB1 (0.63) CHRNB1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL24760047 0.70 CHRNB2 (0.63) CHRNB2CHRNB4CHRNA3
SCHEMBL3322615 0.70 CHRNB2 (0.60) CHRNB1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL3322622 0.70 CHRNB2 (0.60) CHRNB1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL8436708 0.70 CHRNB4 (0.65) CHRNB1CHRNB2CHRNB4CHRNA3CHRNA4

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-20220402935-A1 HETEROCYCLIC COMPOUND FIMECS, INC. (JP) 2022-12-22 — — US disclosed
EP-4006037-A1 HETEROCYCLIC COMPOUND Fimecs, Inc. (JP) 2022-06-01 — — EP 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-20220402935-A1 HETEROCYCLIC COMPOUND IRAK1, IRAK2, IRAK4 CHRNB1 3922/4885CHRNB2 4774/4885CHRNB4 4858/4885

“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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