SCHEMBL27029971

SCHEMBL27029971

O=C(O)N1C[C@@H]2CNO[C@@H]2C1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 13/20 0.34
CHRNB4 P30926 13/20 0.34
CHRNA3 P32297 13/20 0.34
CHRNA4 P43681 13/20 0.34
CHRNA7 P36544 11/20 0.33

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
SCHEMBL29118029 1.00 CHRNB2 (0.34) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL29118030 1.00 CHRNB2 (0.34) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL18498189 0.72 NAMPT (0.34) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL19211588 0.72 CHRNB2 (0.32) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL19211575 0.72 CHRNB2 (0.32) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL19211581 0.72 CHRNB2 (0.32) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL18498060 0.71 CHRNB2 (0.39) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL18498063 0.71 CHRNB2 (0.39) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL5241040 0.70 CHRNB2 (0.33) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL666529 0.70 CHRNB2 (0.30) CHRNB2CHRNA3CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240208981-A1 NITROGEN-CONTAINING HETEROCYCLIC POLYCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF JIANGSU HANSOH PHARMACEUTICAL GROUP CO., LTD. (CN) 2024-06-27 US disclosed
EP-4310089-A1 NITROGEN-CONTAINING HETEROCYCLIC POLYCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF Shanghai Hansoh Biomedical Co., Ltd. (CN) 2024-01-24 EP disclosed
WO-2022194122-A1 NITROGEN-CONTAINING HETEROCYCLIC POLYCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 上海翰森生物医药科技有限公司 2022-09-22 WO 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-20240208981-A1 NITROGEN-CONTAINING HETEROCYCLIC POLYCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF HCRTR1, HCRTR2, CCKBR CHRNB2 776/4885CHRNB4 722/4885CHRNA3 769/4885

“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.