SCHEMBL10054588

SCHEMBL10054588

C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.47
USP2 O75604 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
DDB1 Q16531 2/20 0.40
CRBN Q96SW2 2/20 0.40
HPGD P15428 1/20 0.40
USP30 Q70CQ3 1/20 0.38
RECQL P46063 1/20 0.38
EPHX1 P07099 1/20 0.38
NAMPT P43490 1/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
CHRM2 P08172 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
RORC P51449 1/20 0.36
EPHX2 P34913 1/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL13438476 1.00 NR1H2 (0.47) NR1H2USP2SMN1; SMN2DDB1CRBN
SCHEMBL19385409 1.00 NR1H2 (0.47) NR1H2USP2SMN1; SMN2DDB1CRBN
SCHEMBL22874296 1.00 NR1H2 (0.47) NR1H2USP2SMN1; SMN2DDB1CRBN
SCHEMBL1536087 0.85 HPGD (0.47) NR1H2USP2SMN1; SMN2HPGDUSP30
SCHEMBL31434076 0.85 HPGD (0.47) NR1H2USP2SMN1; SMN2DDB1CRBN
SCHEMBL19889963 0.85 HPGD (0.47) NR1H2USP2SMN1; SMN2DDB1CRBN
SCHEMBL31433887 0.85 HPGD (0.47) NR1H2USP2SMN1; SMN2DDB1CRBN
SCHEMBL19890506 0.85 HPGD (0.47) NR1H2USP2SMN1; SMN2DDB1CRBN
SCHEMBL31434084 0.85 HPGD (0.47) NR1H2USP2SMN1; SMN2DDB1CRBN
SCHEMBL13438545 0.85 NR1H2 (0.46) NR1H2USP2SMN1; SMN2DDB1CRBN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11945797-B2 1-cyano-pyrrolidine derivatives as dub inhibitors MISSION THERAPEUTICS LIMITED (GB) 2024-04-02 US disclosed
US-20220177451-A1 1-CYANO-PYRROLIDINE DERIVATIVES AS DUB INHIBITORS MISSION THERAPEUTICS LIMITED (GB) 2022-06-09 US disclosed
US-20220177451-A1 1-CYANO-PYRROLIDINE DERIVATIVES AS DUB INHIBITORS MISSION THERAPEUTICS LIMITED (GB) 2022-06-09 US disclosed
US-11352339-B2 1-cyano-pyrrolidine derivatives as DUB inhibitors MISSION THERAPEUTICS LIMITED (GB) 2022-06-07 US disclosed
US-11352339-B2 1-cyano-pyrrolidine derivatives as DUB inhibitors MISSION THERAPEUTICS LIMITED (GB) 2022-06-07 US disclosed
EP-3433246-B1 1-CYANO-PYRROLIDINE DERIVATIVES AS DBU INHIBITORS MISSION THERAPEUTICS LTD (GB) 2022-05-04 EP disclosed
EP-3433246-B1 1-CYANO-PYRROLIDINE DERIVATIVES AS DBU INHIBITORS MISSION THERAPEUTICS LTD (GB) 2022-05-04 EP disclosed
CN-108884068-B 1-cyano-pyrrolidine derivatives as DUB inhibitors 特殊治疗有限公司 2021-02-26 CN disclosed
US-20200331888-A1 1-CYANO-PYRROLIDINE DERIVATIVES AS DUB INHIBITORS MISSION THERAPEUTICS LIMITED (GB) 2020-10-22 US disclosed
WO-2017163078-A1 1-CYANO-PYRROLIDINE DERIVATIVES AS DBU INHIBITORS MISSION THERAPEUTICS LIMITED (GB) 2017-09-28 WO disclosed
US-8497383-B2 HIV protease inhibitors MERCK SHARP & DOHME CORP. (US) 2013-07-30 US disclosed
US-20120142752-A1 HIV PROTEASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2012-06-07 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 (5 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-20120142752-A1 HIV PROTEASE INHIBITORS SERPINB1, PRSS1, SERPINB6 NR1H2 2281/4885USP2 2576/4885SMN1; SMN2 4250/4885
US-11352339-B2 1-cyano-pyrrolidine derivatives as DUB inhibitors USP30, USP28, USP1 NR1H2 3483/4885USP2 16/4885SMN1; SMN2 4629/4885
US-20220177451-A1 1-CYANO-PYRROLIDINE DERIVATIVES AS DUB INHIBITORS USP30, USP28, USP1 NR1H2 3483/4885USP2 16/4885SMN1; SMN2 4629/4885
US-11945797-B2 1-cyano-pyrrolidine derivatives as dub inhibitors USP30, USP28, USP1 NR1H2 3483/4885USP2 16/4885SMN1; SMN2 4629/4885
US-20200331888-A1 1-CYANO-PYRROLIDINE DERIVATIVES AS DUB INHIBITORS USP30, USP28, USP1 NR1H2 3483/4885USP2 16/4885SMN1; SMN2 4629/4885

“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.