SCHEMBL8511562

SCHEMBL8511562

CC(C)(C)OC(=O)NC(C(=O)OC1CN2CCC1CC2)c1ccc(Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
GLA P06280 1/20 0.51
CHRM3 P20309 1/20 0.47
NTMT1 Q9BV86 1/20 0.47
MAPT P10636 1/20 0.46
GAA P10253 1/20 0.44
ATM Q13315 1/20 0.44
CACNA1B Q00975 1/20 0.43
LSS P48449 1/20 0.43
CHRNA7 P36544 4/20 0.43
BCHE P06276 1/20 0.43
ACHE P22303 1/20 0.43
TSHR P16473 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
ALDH1A1 P00352 1/20 0.41
S1PR3 Q99500 1/20 0.41

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
SCHEMBL8511559 1.00 NPC1 (0.55) NPC1RAB9AGLACHRM3NTMT1
SCHEMBL8511560 0.91 CHRM3 (0.48) NPC1RAB9ACHRM3NTMT1CHRNA7
SCHEMBL8511564 0.91 CHRM3 (0.48) NPC1RAB9ACHRM3NTMT1CHRNA7
SCHEMBL8511989 0.90 CHRM3 (0.47) NPC1RAB9ACHRM3NTMT1CHRNA7
SCHEMBL8511994 0.90 CHRM3 (0.47) NPC1RAB9ACHRM3NTMT1CHRNA7
SCHEMBL2483667 0.90 CHRM3 (0.60) CHRM3CHRNA7BCHEACHE
SCHEMBL2483663 0.90 CHRM3 (0.60) CHRM3CHRNA7BCHEACHE
SCHEMBL8513056 0.90 CHRM3 (0.60) CHRM3CHRNA7BCHEACHE
SCHEMBL15755702 0.90 CHRM3 (0.60) CHRM3CHRNA7BCHEACHE
SCHEMBL8511339 0.89 NTMT1 (0.48) NPC1RAB9ACHRM3NTMT1CACNA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2643295-B1 GLYCINE DERIVATIVES AND THEIR USE AS MUSCARINIC RECEPTOR ANTAGONISTS CHIESI FARMA SPA (IT) 2016-04-13 EP disclosed
US-8772314-B2 Glycine derivatives and medicinal compositions thereof CHIESI FARMACEUTICI S.P.A. (IT) 2014-07-08 US disclosed
EP-2643295-A1 GLYCINE DERIVATIVES AND THEIR USE AS MUSCARINIC RECEPTOR ANTAGONISTS Chiesi Farmaceutici S.p.A. (IT) 2013-10-02 EP disclosed
US-20120134934-A1 GLYCINE DERIVATIVES AND MEDICINAL COMPOSITIONS THEREOF CHIESI FARMACEUTICI S.P.A. (IT) 2012-05-31 US disclosed
WO-2012069275-A1 GLYCINE DERIVATIVES AND THEIR USE AS MUSCARINIC RECEPTOR ANTAGONISTS CHIESI FARMACEUTICI S.P.A. (IT) 2012-05-31 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-20120134934-A1 GLYCINE DERIVATIVES AND MEDICINAL COMPOSITIONS THEREOF CHRM3, GLRB, CHRNG NPC1 2568/4885RAB9A 1487/4885GLA 942/4885

“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.