SCHEMBL23360381

SCHEMBL23360381

COc1ccc(N[C@H]2CCN(C(=O)O)C2)c2cccnc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 7/20 0.45
ALDH1A1 P00352 2/20 0.44
GAA P10253 2/20 0.44
HSD17B10 Q99714 2/20 0.44
USP2 O75604 1/20 0.44
MAPK1 P28482 1/20 0.44
PDE4A P27815 3/20 0.42
PDE4B Q07343 3/20 0.42
PDE4C Q08493 3/20 0.42
HTT P42858 1/20 0.41
JAK2 O60674 2/20 0.41
JAK3 P52333 2/20 0.41
PIK3CD O00329 2/20 0.40
PIK3CA P42336 2/20 0.40
USP30 Q70CQ3 1/20 0.40
EPHX2 P34913 1/20 0.40
RPS6KB1 P23443 1/20 0.40
NOS3 P29474 1/20 0.39
NOS1 P29475 1/20 0.39
NOS2 P35228 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
SCHEMBL23359906 1.00 PDE4D (0.45) PDE4DALDH1A1GAAHSD17B10USP2
SCHEMBL23359904 1.00 PDE4D (0.45) PDE4DALDH1A1GAAHSD17B10USP2
SCHEMBL23360169 0.92 HTR1A (0.49) ALDH1A1GAAHSD17B10USP2MAPK1
SCHEMBL23360171 0.92 HTR1A (0.49) ALDH1A1GAAHSD17B10USP2MAPK1
SCHEMBL23359923 0.90 NOS2 (0.43) ALDH1A1GAAHTTJAK2JAK3
SCHEMBL28834157 0.87 USP30 (0.49) ALDH1A1GAAHSD17B10USP2MAPK1
SCHEMBL29863210 0.87 USP30 (0.49) ALDH1A1GAAHSD17B10USP2MAPK1
SCHEMBL29862661 0.87 USP30 (0.49) ALDH1A1GAAHSD17B10USP2MAPK1
SCHEMBL28834238 0.87 USP30 (0.49) ALDH1A1GAAHSD17B10USP2MAPK1
SCHEMBL28834155 0.87 USP30 (0.49) ALDH1A1GAAHSD17B10USP2MAPK1

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-11655235-B2 Pyrrolidine and piperidine compounds YUHAN CORPORATION (KR) 2023-05-23 US disclosed
EP-4055014-A1 PYRROLIDINE AND PIPERIDINE COMPOUNDS Yuhan Corporation (KR) 2022-09-14 EP disclosed
US-20210147386-A1 PYRROLIDINE AND PIPERIDINE COMPOUNDS YUHAN CORPORATION (KR) 2021-05-20 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 (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-11655235-B2 Pyrrolidine and piperidine compounds FAP, APC, VHL PDE4D 220/4885ALDH1A1 439/4885GAA 98/4885
US-20210147386-A1 PYRROLIDINE AND PIPERIDINE COMPOUNDS FAP, APC, VHL PDE4D 220/4885ALDH1A1 439/4885GAA 98/4885

“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.