SCHEMBL23883141

SCHEMBL23883141

CCC(C)=CC/C=C(/C)CCC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
SLC15A2 Q16348 1/20 0.42
IMPDH2 P12268 15/20 0.41
ALKBH5 Q6P6C2 1/20 0.39
SUCNR1 Q9BXA5 1/20 0.39
EGLN1 Q9GZT9 1/20 0.39
FFAR3 O14843 2/20 0.39
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38

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
SCHEMBL22555420 1.00 LMNA (0.42) LMNASLC15A2IMPDH2ALKBH5SUCNR1
SCHEMBL30166944 1.00 LMNA (0.42) LMNASLC15A2IMPDH2ALKBH5SUCNR1
SCHEMBL23883139 1.00 LMNA (0.42) LMNASLC15A2IMPDH2ALKBH5SUCNR1
SCHEMBL21176647 0.79 LMNA (0.48) LMNASLC15A2IMPDH2ALKBH5SUCNR1
SCHEMBL8468128 0.79 LMNA (0.48) LMNASLC15A2IMPDH2ALKBH5SUCNR1
SCHEMBL28052364 0.78 FNTA (0.55) FNTAFNTB
SCHEMBL28052468 0.78 FNTA (0.55) FNTAFNTB
SCHEMBL8017843 0.78 LMNA (0.42) LMNASLC15A2IMPDH2ALKBH5SUCNR1
SCHEMBL8017847 0.78 LMNA (0.42) LMNASLC15A2IMPDH2ALKBH5SUCNR1
SCHEMBL3642589 0.78 ALDH1A1 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4126809-A2 COMPOSITIONS AND METHODS FOR INHIBITING VIBRIO INFECTION Cornell University (US) 2023-02-08 EP disclosed
WO-2021202632-A2 COMPOSITIONS AND METHODS FOR INHIBITING VIBRIO INFECTION CORNELL UNIVERSITY (US) 2021-10-07 WO disclosed