SCHEMBL20835372

SCHEMBL20835372

CC(F)(F)[C@H]1CC[C@@H](c2cccc(F)c2)N1C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 3/20 0.51
CALCRL Q16602 14/20 0.46
PDE5A O76074 1/20 0.45
MAOA P21397 1/20 0.39
MAOB P27338 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
SCHEMBL28908005 0.90 RIPK1 (0.51) RIPK1CALCRLPDE5AMAOAMAOB
SCHEMBL20835474 0.86 CALCRL (0.50) RIPK1CALCRLPDE5A
SCHEMBL20835879 0.86 RIPK1 (0.48) RIPK1CALCRLPDE5A
SCHEMBL20835925 0.86 CALCRL (0.49) RIPK1CALCRLPDE5A
SCHEMBL20835539 0.86 CALCRL (0.49) RIPK1CALCRLPDE5AMAOAMAOB
SCHEMBL20835532 0.86 RIPK1 (0.48) RIPK1CALCRLPDE5A
SCHEMBL28521349 0.85 RIPK1 (0.50) RIPK1CALCRLPDE5AMAOAMAOB
SCHEMBL20835601 0.85 CALCRL (0.50) RIPK1CALCRLPDE5A
SCHEMBL20835868 0.84 RIPK1 (0.46) RIPK1CALCRLPDE5A
SCHEMBL20843517 0.84 CALCRL (0.50) RIPK1CALCRLPDE5A

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 3 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
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 RIPK1 1917/4885CALCRL 1/4885PDE5A 439/4885
US-10995084-B2 Pyrrolidine derivative CALCRL, NPY1R, GRPR RIPK1 1917/4885CALCRL 1/4885PDE5A 439/4885

“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.