SCHEMBL23927772

SCHEMBL23927772

CCOCOc1ccccc1C1(C)CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGDR Q13258 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.39
KMT2A Q03164 2/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
ALDH1A1 P00352 3/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HCN1 O60741 2/20 0.33
HCN4 Q9Y3Q4 2/20 0.33
SLC6A2 P23975 3/20 0.33
SLC6A3 Q01959 3/20 0.33
SLC6A4 P31645 2/20 0.33
CYP2C19 P33261 1/20 0.32
MEN1 O00255 1/20 0.32
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CETP P11597 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
SCHEMBL19639458 0.94 PTGDR (0.39) PTGDRPTGDR2KMT2ALMNAGAA
SCHEMBL17847413 0.80 PTGDR (0.44) PTGDRPTGDR2KMT2ALMNAALDH1A1
SCHEMBL22871193 0.79 ALDH1A1 (0.47) KMT2ALMNAGAAALDH1A1NPSR1
SCHEMBL17847398 0.78 PTGDR2 (0.43) PTGDRPTGDR2SLC6A4CETP
SCHEMBL19639459 0.77 PTGDR (0.44) PTGDRPTGDR2
SCHEMBL8681745 0.77 PTGDR (0.43) PTGDRPTGDR2KMT2ALMNAALDH1A1
SCHEMBL11919524 0.75 SIGMAR1 (0.49) KMT2ALMNAALDH1A1NPSR1HPGD
SCHEMBL17847410 0.74 LMNA (0.31) PTGDRPTGDR2KMT2ALMNAGAA
SCHEMBL8751778 0.74 L3MBTL1 (0.47) LMNAGAAALDH1A1NPSR1SLC6A2
SCHEMBL28642852 0.74 PTGDR (0.35) PTGDRPTGDR2GAASLC6A2SLC6A3

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-3233806-B1 HETEROCYCLIC COMPOUNDS, PROCESS FOR THEIR PREPARATION AND USE THEREOF IN MEDICINE AS WELL AS IN COSMETICS GALDERMA RES & DEV (FR) 2021-10-27 EP disclosed