SCHEMBL20835488

SCHEMBL20835488

CCOC(=O)[C@H]1CC[C@@H](c2ccccc2)N1C(=O)OC(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TYMS P04818 1/20 0.48
ABCB1 P08183 1/20 0.47
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
TSHR P16473 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
RIPK1 Q13546 1/20 0.41
NR1D1 P20393 1/20 0.41
GPR119 Q8TDV5 1/20 0.41

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
SCHEMBL20835473 0.89 GPR119 (0.43) TYMSABCB1TSHRKMT2ANR1D1
SCHEMBL4437760 0.88 MAOA (0.43) TYMSMAOAMAOBTSHRMEN1
SCHEMBL4441921 0.88 TYMS (0.41) TYMSMEN1KMT2AGPR119
SCHEMBL2351853 0.88 TYMS (0.41) TYMSMEN1KMT2AGPR119
SCHEMBL2348191 0.88 MAOA (0.43) TYMSMAOAMAOBTSHRMEN1
SCHEMBL3589461 0.88 TYMS (0.41) TYMSMEN1KMT2AGPR119
SCHEMBL1104537 0.88 MAPT (0.47) MEN1KMT2A
SCHEMBL2581106 0.87 TP53 (0.44) TYMSABCB1TSHRMEN1KMT2A
SCHEMBL2584143 0.87 RIPK1 (0.46) TYMSABCB1RIPK1NR1D1GPR119
SCHEMBL22358312 0.86 ABCB1 (0.47) ABCB1KMT2ARIPK1GPR119

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 4 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

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-20200299273-A1 PYRROLIDINE DERIVATIVE CALCRL, NPY1R, GRPR TYMS 3108/4885ABCB1 1573/4885MAOA 2459/4885
US-10995084-B2 Pyrrolidine derivative CALCRL, NPY1R, GRPR TYMS 3108/4885ABCB1 1573/4885MAOA 2459/4885

“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.