SCHEMBL9288995

SCHEMBL9288995

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

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CHRM3 P20309 6/20 0.61
▸ CHRNA7 P36544 2/20 0.53
▸ BCHE P06276 1/20 0.53
▸ ACHE P22303 1/20 0.53
▸ CHRM2 P08172 5/20 0.50
▸ CHRM1 P11229 5/20 0.50
▸ CYP2D6 P10635 1/20 0.50
▸ CHRM4 P08173 1/20 0.48
▸ CHRM5 P08912 1/20 0.48

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
SCHEMBL16789085 0.93 CHRM3 (0.62) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL8510174 0.88 CHRM3 (0.63) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL8510178 0.88 CHRM3 (0.63) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL8512405 0.87 CHRM3 (0.65) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL8512408 0.87 CHRM3 (0.65) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL8509919 0.85 CHRM3 (0.60) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL8509921 0.85 CHRM3 (0.60) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL8509486 0.85 CHRM3 (0.57) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL8509484 0.85 CHRM3 (0.57) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL8509480 0.85 CHRM3 (0.62) CHRM3CHRNA7BCHEACHECHRM2

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-8772314-B2 Glycine derivatives and medicinal compositions thereof CHIESI FARMACEUTICI S.P.A. (IT) 2014-07-08 — — US disclosed
US-20120134934-A1 GLYCINE DERIVATIVES AND MEDICINAL COMPOSITIONS THEREOF CHIESI FARMACEUTICI S.P.A. (IT) 2012-05-31 — — 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-20120134934-A1 GLYCINE DERIVATIVES AND MEDICINAL COMPOSITIONS THEREOF CHRM3, GLRB, CHRNG CHRM3 1/4885CHRNA7 48/4885BCHE 134/4885

“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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