SCHEMBL17554271

SCHEMBL17554271

C#CC(=O)OC#CCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.41
FFAR4 Q5NUL3 2/20 0.41
TDP1 Q9NUW8 3/20 0.37
SLC6A2 P23975 1/20 0.37
SLC6A3 Q01959 1/20 0.37
KMT2A Q03164 1/20 0.37
NPC1 O15118 1/20 0.36
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
AKR1B1 P15121 1/20 0.35
SRR Q9GZT4 2/20 0.35
ALDH1A1 P00352 4/20 0.34
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
HAO1 Q9UJM8 1/20 0.34
MAPK1 P28482 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL14775107 0.82 FFAR1 (0.45) FFAR1FFAR4TDP1SLC6A2SLC6A3
SCHEMBL14775110 0.82 AKR1B1 (0.45) FFAR1FFAR4TDP1SLC6A2SLC6A3
SCHEMBL29188727 0.73 ALDH1A1 (0.40) FFAR1FFAR4TDP1SLC6A2SLC6A3
SCHEMBL28012927 0.73 ALDH1A1 (0.41) FFAR1FFAR4TDP1SLC6A2SLC6A3
SCHEMBL9128675 0.71 TP53 (0.42) FFAR1FFAR4TDP1SLC6A2SLC6A3
SCHEMBL29211076 0.71 FFAR1 (0.45) FFAR1FFAR4TDP1SLC6A2SLC6A3
SCHEMBL907611 0.71 ALDH1A1 (0.57) TDP1SLC6A2SLC6A3KMT2ANPC1
Propiolic Acid SCHEMBL17554270 0.70 CES2 (0.43) FFAR1FFAR4SLC6A3KMT2ANPC1
Bicarbonate SCHEMBL27692050 0.69 CES2 (0.46) FFAR1FFAR4SLC6A3KMT2ANPC1
SCHEMBL6075646 0.68 MAOB (0.39) FFAR1FFAR4TDP1SLC6A2SLC6A3

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-2992947-B1 METHOD FOR THE PREPARATION OF MICROPOROUS ORGANIC MEMBRANES, MICROPOROUS ORGANIC MEMBRANES AND USE OF SAME KARLSRUHER INST TECHNOLOGIE (DE) 2023-03-01 EP disclosed
EP-2992947-A1 METHOD FOR THE PREPARATION OF MICROPOROUS ORGANIC MEMBRANES, MICROPOROUS ORGANIC MEMBRANES AND USE OF SAME Karlsruher Institut für Technologie (DE) 2016-03-09 EP disclosed