SCHEMBL16789085

SCHEMBL16789085

CNC(C(=O)O[C@H]1CN2CCC1CC2)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CHRM3 P20309 6/20 0.62
▸ CHRNA7 P36544 2/20 0.57
▸ BCHE P06276 1/20 0.57
▸ ACHE P22303 1/20 0.57
▸ CYP2D6 P10635 1/20 0.54
▸ CHRM2 P08172 5/20 0.54
▸ CHRM1 P11229 5/20 0.54
▸ CHRM4 P08173 1/20 0.52
▸ CHRM5 P08912 1/20 0.52

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
SCHEMBL9288995 0.93 CHRM3 (0.61) CHRM3CHRNA7BCHEACHECYP2D6
SCHEMBL8512408 0.89 CHRM3 (0.65) CHRM3CHRNA7BCHEACHECYP2D6
SCHEMBL8512405 0.89 CHRM3 (0.65) CHRM3CHRNA7BCHEACHECYP2D6
SCHEMBL8510174 0.88 CHRM3 (0.63) CHRM3CHRNA7BCHEACHECYP2D6
SCHEMBL8510178 0.88 CHRM3 (0.63) CHRM3CHRNA7BCHEACHECYP2D6
SCHEMBL12071819 0.88 CHRM3 (0.62) CHRM3CHRNA7BCHEACHECYP2D6
SCHEMBL1695933 0.88 CHRM3 (0.62) CHRM3CHRNA7BCHEACHECYP2D6
SCHEMBL1695975 0.88 CHRM3 (0.62) CHRM3CHRNA7BCHEACHECYP2D6
SCHEMBL1695935 0.88 CHRM3 (0.62) CHRM3CHRNA7BCHEACHECYP2D6
SCHEMBL2486482 0.88 CHRM3 (0.62) CHRM3CHRNA7BCHEACHECYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3077385-B1 HETEROARYL DERIVATIVES FOR THE TREATMENT OF RESPIRATORY DISEASES CHIESI FARM SPA (IT) 2017-10-04 — — EP disclosed
US-9133185-B2 Heteroaryl derivatives CHIESI FARMACEUTICI S.P.A (IT) 2015-09-15 — — US disclosed
US-9133185-B2 Heteroaryl derivatives CHIESI FARMACEUTICI S.P.A (IT) 2015-09-15 — — US disclosed
US-20150158858-A1 HETEROARYL DERIVATIVES CHIESI FARMACEUTICI S.P.A. (IT) 2015-06-11 — — US disclosed
WO-2015082616-A1 HETEROARYL DERIVATIVES FOR THE TREATMENT OF RESPIRATORY DISEASES CHIESI FARMACEUTICI S.P.A. (IT) 2015-06-11 — — WO disclosed
US-20150158858-A1 HETEROARYL DERIVATIVES CHIESI FARMACEUTICI S.P.A. (IT) 2015-06-11 — — 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-20150158858-A1 HETEROARYL DERIVATIVES PDE4A, PDE4B, PDE3A CHRM3 4/4885CHRNA7 86/4885BCHE 535/4885

“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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