SCHEMBL21765294

SCHEMBL21765294

CC(C)(C)OC(=O)N1CCC2(CC1)CN(c1ccc(C#N)cc1)C(=O)N2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.52
OPRL1 P41146 2/20 0.52
GPR119 Q8TDV5 3/20 0.47
JAK2 O60674 2/20 0.43
JAK1 P23458 2/20 0.43
EGLN2 Q96KS0 2/20 0.42
AR P10275 1/20 0.42
ITGB3 P05106 2/20 0.41
ITGA2B P08514 2/20 0.41
HRH3 Q9Y5N1 2/20 0.40
CYP3A4 P08684 2/20 0.40
CYP2C19 P33261 2/20 0.40
USP30 Q70CQ3 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ACACA Q13085 1/20 0.39
USP2 O75604 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39

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
SCHEMBL21406801 0.86 RORC (0.45) OPRM1OPRL1GPR119JAK2JAK1
SCHEMBL21753226 0.86 HDAC2 (0.47) OPRM1OPRL1JAK2JAK1ITGB3
SCHEMBL18319256 0.85 OPRL1 (0.49) OPRM1OPRL1GPR119ITGB3ITGA2B
SCHEMBL18319201 0.84 OPRM1 (0.56) OPRM1OPRL1GPR119JAK2JAK1
SCHEMBL21753334 0.83 OPRL1 (0.58) OPRM1OPRL1ITGB3ITGA2BACACA
SCHEMBL21753235 0.82 CYP3A4 (0.49) GPR119JAK2JAK1CYP3A4CYP2C19
SCHEMBL21753327 0.81 HRH3 (0.55) GPR119JAK2JAK1EGLN2AR
SCHEMBL21753329 0.81 ACACA (0.53) GPR119JAK2JAK1EGLN2AR
SCHEMBL21151347 0.80 GPR119 (0.48) GPR119JAK2JAK1EGLN2AR
SCHEMBL21753417 0.79 OPRL1 (0.48) OPRM1OPRL1GPR119CYP3A4USP30

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
US-11731972-B2 Spiro compounds as glycosidase inhibitors ASCENEURON SA (CH) 2023-08-22 US disclosed
US-11731972-B2 Spiro compounds as glycosidase inhibitors ASCENEURON SA (CH) 2023-08-22 US disclosed
US-11731972-B2 Spiro compounds as glycosidase inhibitors ASCENEURON SA (CH) 2023-08-22 US disclosed
US-20210206766-A1 SPIRO COMPOUNDS AS GLYCOSIDASE INHIBITORS ASCENEURON SA (CH) 2021-07-08 US disclosed
US-20210206766-A1 SPIRO COMPOUNDS AS GLYCOSIDASE INHIBITORS ASCENEURON SA (CH) 2021-07-08 US disclosed
WO-2020039029-A1 SPIRO COMPOUNDS AS GLYCOSIDASE INHIBITORS ASCENEURON S. A. (CH) 2020-02-27 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 (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-20210206766-A1 SPIRO COMPOUNDS AS GLYCOSIDASE INHIBITORS GLA, BACE1, GAA OPRM1 4610/4885OPRL1 2321/4885GPR119 427/4885
US-11731972-B2 Spiro compounds as glycosidase inhibitors GLA, BACE1, GAA OPRM1 4610/4885OPRL1 2321/4885GPR119 427/4885

“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.