SCHEMBL8214876

SCHEMBL8214876

CCOC(=O)[C@H]1C[C@@H](C)C(=O)N1C(=O)OC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
ALDH1A1 P00352 3/20 0.36
TSHR P16473 1/20 0.36
GLA P06280 1/20 0.35
FKBP1A P62942 2/20 0.34
ADORA1 P30542 1/20 0.34
KDM4E B2RXH2 3/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
NR1H2 P55055 1/20 0.34
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
KLK7 P49862 1/20 0.33

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
SCHEMBL15896630 1.00 MAPT (0.38) MAPTNFKB1NFKB2RELAMEN1
SCHEMBL25517002 1.00 MAPT (0.38) MAPTNFKB1NFKB2RELAMEN1
SCHEMBL18593159 1.00 MAPT (0.38) MAPTNFKB1NFKB2RELAMEN1
SCHEMBL12423750 1.00 MAPT (0.38) MAPTNFKB1NFKB2RELAMEN1
SCHEMBL15348414 0.88 ALDH1A1 (0.38) MAPTNFKB1NFKB2RELAMEN1
SCHEMBL15348412 0.88 ALDH1A1 (0.38) MAPTNFKB1NFKB2RELAMEN1
SCHEMBL1785924 0.87 MAPK1 (0.38) MAPTKDM4EHPGDNR1H2CHRM2
SCHEMBL8354068 0.87 MAPK1 (0.38) MAPTKDM4EHPGDNR1H2CHRM2
SCHEMBL18593158 0.86 MAPT (0.38) MAPTNFKB1NFKB2RELAMEN1
SCHEMBL30992286 0.86 MAPT (0.44) MAPTNFKB1NFKB2RELAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10995084-B2 Pyrrolidine derivative KISSEI PHARMACEUTICAL CO., LTD. (JP) 2021-05-04 US disclosed
CN-109476639-B Pyrrolidine derivatives 橘生药品工业股份有限公司 2021-02-26 CN disclosed
US-20200299273-A1 PYRROLIDINE DERIVATIVE KISSEI PHARMACEUTICAL CO., LTD. (JP) 2020-09-24 US disclosed
EP-3459941-A1 PYRROLIDINE DERIVATIVE Kissei Pharmaceutical Co., Ltd. (JP) 2019-03-27 EP disclosed
US-8039467-B2 Compounds for the treatment of inflammatory disorders SCHERING CORPORATION (US) 2011-10-18 US disclosed
US-20100145048-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS SCHERING CORPORATION 2010-06-10 US disclosed
US-7652020-B2 novel hydantoin derivatives to inhibit matrix metalloproteinases (MMPs), a disintegrin and metalloproteases (ADAMs) and/or tumor necrosis factor alpha converting enzyme (TACE) and in so doing prevent the release of tumor necrosis factor alpha (TNF- alpha ); autoimmune diseases; side effect reduction SCHERING CORPORATION (US) 2010-01-26 US disclosed
US-7638513-B2 Compounds for the treatment of inflammatory disorders SCHERING CORPORATION (US) 2009-12-29 US disclosed
US-20070167426-A1 Compounds for the treatment of inflammatory disorders and microbial diseases SCHERING CORPORATION 2007-07-19 US disclosed
WO-2007064749-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS AND MICROBIAL DISEASES SCHERING CORPORATION (US) 2007-06-07 WO disclosed
US-20060178366-A1 Compounds for the treatment of inflammatory disorders SCHERING CORPORATION 2006-08-10 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-20070167426-A1 Compounds for the treatment of inflammatory disorders and microbial diseases MMP12, ADAMTS1, ADAM33 MAPT 739/4885NFKB1 482/4885NFKB2 448/4885
US-20200299273-A1 PYRROLIDINE DERIVATIVE CALCRL, NPY1R, GRPR MAPT 4032/4885NFKB1 1011/4885NFKB2 1368/4885
US-10995084-B2 Pyrrolidine derivative CALCRL, NPY1R, GRPR MAPT 4032/4885NFKB1 1011/4885NFKB2 1368/4885
US-20060178366-A1 Compounds for the treatment of inflammatory disorders MMP12, ADAMTS1, TNF MAPT 874/4885NFKB1 329/4885NFKB2 252/4885
US-20100145048-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS TNF, MMP12, MMP8 MAPT 817/4885NFKB1 148/4885NFKB2 126/4885

“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.