SCHEMBL20835548

SCHEMBL20835548

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

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 3/20 0.45
PDE5A O76074 1/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39
FFAR2 O15552 5/20 0.39
MAOB P27338 2/20 0.39
MAOA P21397 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
DRD4 P21917 1/20 0.37
NPC1 O15118 1/20 0.37

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
SCHEMBL20835556 0.90 RIPK1 (0.47) RIPK1PDE5AHPGDHTTALDH1A1
SCHEMBL20835929 0.87 FFAR2 (0.44) RIPK1FFAR2
SCHEMBL20835862 0.86 MAOB (0.41) KDM4EFFAR2MAOBMAOADRD4
SCHEMBL20835736 0.85 FFAR2 (0.43) RIPK1FFAR2
SCHEMBL20835422 0.85 FFAR2 (0.49) RIPK1PDE5AFFAR2MAOBMAOA
SCHEMBL28523802 0.83 RIPK1 (0.48) RIPK1PDE5AALDH1A1KDM4EPKM
SCHEMBL20835830 0.81 FFAR2 (0.39) RIPK1FFAR2
SCHEMBL20835460 0.80 FFAR2 (0.39) ALDH1A1FFAR2
SCHEMBL20835697 0.80 RIPK1 (0.41) RIPK1PDE5AALDH1A1FFAR2MAOB
SCHEMBL20835378 0.78 RIPK1 (0.46) RIPK1PDE5AHPGDHTTALDH1A1

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 1917/4885PDE5A 439/4885HPGD 818/4885
US-10995084-B2 Pyrrolidine derivative CALCRL, NPY1R, GRPR RIPK1 1917/4885PDE5A 439/4885HPGD 818/4885

“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.