SCHEMBL21753329

SCHEMBL21753329

CC(C)(C)OC(=O)N1CCC2(CC1)CC(=O)N(c1ccc(C#N)cc1)C2

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACACA Q13085 2/20 0.53
ITGB3 P05106 5/20 0.51
ITGA2B P08514 5/20 0.51
GPR119 Q8TDV5 2/20 0.47
KCNJ1 P48048 1/20 0.45
CYP3A4 P08684 2/20 0.44
CYP2C19 P33261 2/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPK1 P28482 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CYP2D6 P10635 2/20 0.43
USP2 O75604 1/20 0.43
CYP2C9 P11712 1/20 0.43
JAK2 O60674 1/20 0.43
JAK1 P23458 1/20 0.43
EGLN2 Q96KS0 2/20 0.42
GPR183 P32249 1/20 0.42
AR P10275 1/20 0.42
ACACB O00763 1/20 0.42

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
SCHEMBL10111315 0.87 ITGB3 (0.54) ACACAITGB3ITGA2BGPR119CYP2C19
SCHEMBL17925128 0.85 KCNJ1 (0.49) ACACAGPR119KCNJ1EGLN2
SCHEMBL22914827 0.83 EGLN2 (0.52) GPR119CYP3A4CYP2C19ALDH1A1MAPK1
SCHEMBL21753280 0.83 ACACA (0.56) ACACAITGB3ITGA2BKCNJ1CYP3A4
SCHEMBL289645 0.83 ITGB3 (0.55) ACACAITGB3ITGA2BGPR119JAK2
SCHEMBL21753327 0.81 HRH3 (0.55) ITGB3ITGA2BGPR119CYP3A4CYP2C19
SCHEMBL21765294 0.81 OPRM1 (0.52) ACACAITGB3ITGA2BGPR119CYP3A4
SCHEMBL484627 0.80 CYP11B2 (0.53) GPR119CYP3A4CYP2C19ALDH1A1MAPK1
SCHEMBL18357677 0.80 EGLN2 (0.54) GPR119CYP3A4CYP2C19ALDH1A1MAPK1
SCHEMBL2301444 0.80 ITGB3 (0.50) ACACAITGB3ITGA2BACACB

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 7 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
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 ACACA 339/4885ITGB3 3714/4885ITGA2B 3406/4885
US-11731972-B2 Spiro compounds as glycosidase inhibitors GLA, BACE1, GAA ACACA 339/4885ITGB3 3714/4885ITGA2B 3406/4885

“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.