SCHEMBL6578863

SCHEMBL6578863

C=CCOC(=O)[C@H]1CCCN1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.36
DPP8 Q6V1X1 2/20 0.36
DPP9 Q86TI2 2/20 0.36
DPP7 Q9UHL4 2/20 0.36
FAP Q12884 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
NOS2 P35228 2/20 0.36
NOS3 P29474 1/20 0.36
NOS1 P29475 1/20 0.36
PRCP P42785 2/20 0.36
ELANE P08246 1/20 0.33
CYP3A4 P08684 1/20 0.33
HTR2C P28335 2/20 0.32
POLB P06746 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
HTR2B P41595 1/20 0.31

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
SCHEMBL707799 1.00 DPP4 (0.36) DPP4DPP8DPP9DPP7FAP
SCHEMBL351761 1.00 DPP4 (0.36) DPP4DPP8DPP9DPP7FAP
Hydrochloric Acid SCHEMBL10615023 0.98 DPP4 (0.36) DPP4DPP8DPP9DPP7FAP
Hydrochloric Acid SCHEMBL10615017 0.98 DPP4 (0.36) DPP4DPP8DPP9DPP7FAP
SCHEMBL15886548 0.95 ALDH1A1 (0.38) DPP4DPP8DPP9DPP7FAP
SCHEMBL8521036 0.95 ALDH1A1 (0.38) DPP4DPP8DPP9DPP7FAP
SCHEMBL13278810 0.91 ALDH1A1 (0.36) DPP4ALDH1A1GAACYP3A4POLB
SCHEMBL8726681 0.87 ALDH1A1 (0.33) DPP4DPP8DPP9DPP7FAP
SCHEMBL30713421 0.84 ALDH1A1 (0.42) DPP4ALDH1A1GAANOS2NOS3
SCHEMBL21696620 0.83 DPP4 (0.35) DPP4DPP8DPP9DPP7FAP

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
CN-118234729-A Process for preparing bicyclic glycine-proline compounds and monocyclic glycine-proline intermediates thereof 诺仁制药有限公司 2024-06-21 CN disclosed
EP-1090960-B1 TWO-PACK TYPE CURABLE COMPOSITION AND HARDENER THEREFOR KANEKA CORP (JP) 2004-06-02 EP disclosed
EP-1090960-A1 TWO-PACK TYPE CURABLE COMPOSITION AND HARDENER THEREFOR Kaneka Corporation (JP) 2001-04-11 EP disclosed