SCHEMBL25006483

SCHEMBL25006483

CCCNCCCCCc1ccccc1

nearest known ligand 0.81

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 12/20 0.81
L3MBTL1 Q9Y468 1/20 0.60
S1PR2 O95136 1/20 0.58
S1PR4 O95977 1/20 0.58
S1PR1 P21453 1/20 0.58
S1PR3 Q99500 1/20 0.58

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
SCHEMBL7608570 0.98 SIGMAR1 (0.77) SIGMAR1L3MBTL1
SCHEMBL29107049 0.92 SIGMAR1 (0.82) SIGMAR1L3MBTL1S1PR2S1PR1S1PR3
SCHEMBL9819852 0.92 SIGMAR1 (0.82) SIGMAR1L3MBTL1S1PR2S1PR1S1PR3
SCHEMBL8625670 0.92 SIGMAR1 (0.81) SIGMAR1L3MBTL1
SCHEMBL9034885 0.92 SIGMAR1 (0.82) SIGMAR1L3MBTL1S1PR2S1PR1S1PR3
SCHEMBL29266756 0.92 SIGMAR1 (0.82) SIGMAR1L3MBTL1S1PR2S1PR1S1PR3
SCHEMBL9213367 0.92 SIGMAR1 (0.82) SIGMAR1L3MBTL1S1PR2S1PR1S1PR3
SCHEMBL11132388 0.92 SIGMAR1 (0.82) SIGMAR1L3MBTL1S1PR2S1PR1S1PR3
SCHEMBL7034338 0.92 SIGMAR1 (0.79) SIGMAR1
SCHEMBL7553527 0.91 SIGMAR1 (0.79) SIGMAR1L3MBTL1S1PR2S1PR1S1PR3

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4129402-A1 HYDROXYPYRROLIDINE DERIVATIVE AND MEDICINAL APPLICATION THEREOF Mitsubishi Tanabe Pharma Corporation (JP) 2023-02-08 EP disclosed