SCHEMBL20555604

SCHEMBL20555604

CC1OC2(CCN(C(=O)O)CC2)CN(C)C1=O

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 17/20 0.56
OPRM1 P35372 16/20 0.56
KCNH2 Q12809 11/20 0.43

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
SCHEMBL20555587 0.82 SIGMAR1 (0.53) SIGMAR1OPRM1KCNH2
SCHEMBL20504475 0.82 SIGMAR1 (0.59) SIGMAR1OPRM1KCNH2
SCHEMBL17324891 0.81 OPRM1 (0.47) SIGMAR1OPRM1KCNH2
SCHEMBL20555663 0.81 OPRM1 (0.47) SIGMAR1OPRM1KCNH2
SCHEMBL22288679 0.80 SIGMAR1 (0.49) SIGMAR1OPRM1KCNH2
SCHEMBL17318996 0.79 SIGMAR1 (0.65) SIGMAR1OPRM1KCNH2
SCHEMBL18766532 0.78 SIGMAR1 (0.55) SIGMAR1OPRM1KCNH2
SCHEMBL17317227 0.78 SIGMAR1 (0.45) SIGMAR1OPRM1KCNH2
SCHEMBL13363110 0.77
SCHEMBL17317160 0.76 SIGMAR1 (0.43) SIGMAR1OPRM1KCNH2

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-10927128-B2 Oxadiazaspiro compounds for the treatment of drug abuse and addiction ESTEVE PHARMACEUTICALS. S.A. (ES) 2021-02-23 US disclosed
US-20180327422-A1 OXADIAZASPIRO COMPOUNDS FOR THE TREATMENT OF DRUG ABUSE AND ADDICTION ESTEVE PHARMACEUTICALS, S.A. (ES) 2018-11-15 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 (2 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-20180327422-A1 OXADIAZASPIRO COMPOUNDS FOR THE TREATMENT OF DRUG ABUSE AND ADDICTION OPRD1, OPRM1, OPRK1 SIGMAR1 4/4885OPRM1 2/4885KCNH2 2970/4885
US-10927128-B2 Oxadiazaspiro compounds for the treatment of drug abuse and addiction OPRD1, OPRM1, OPRK1 SIGMAR1 4/4885OPRM1 2/4885KCNH2 2970/4885

“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.