SCHEMBL24923915

SCHEMBL24923915

CNC(=O)c1cc(C)ccc1C=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.44
ALDH1A1 P00352 2/20 0.39
CSNK2A1 P68400 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
MMP13 P45452 1/20 0.39
ERN1 O75460 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
GAA P10253 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 1/20 0.37
HDAC6 Q9UBN7 4/20 0.37
HDAC8 Q9BY41 3/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
GFER P55789 1/20 0.36
PLK1 P53350 1/20 0.36

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
SCHEMBL11301716 0.84 SRC (0.46) SRCALDH1A1CSNK2A1ERN1HDAC7
SCHEMBL29951029 0.82 TYR (0.43) ALDH1A1ERN1GAAKDM4EMEN1
SCHEMBL547527 0.79 CSNK2A1 (0.57) SRCALDH1A1CSNK2A1ERN1KDM4E
SCHEMBL24822948 0.79 SRC (0.47) SRCALDH1A1CSNK2A1ERN1GAA
SCHEMBL25106844 0.79 CYP46A1 (0.50) SRCALDH1A1ERN1GAASMN1; SMN2
SCHEMBL29956204 0.78 TRIM24 (0.56) ALDH1A1ERN1GAASMN1; SMN2KDM4E
SCHEMBL12396262 0.78 SRC (0.46) SRCALDH1A1CSNK2A1ERN1GAA
SCHEMBL12673553 0.78 S1PR4 (0.52) ALDH1A1KMT2A
SCHEMBL4766299 0.77 SMN1; SMN2 (0.57) CSNK2A1SLC6A2SLC6A4SLC6A3MMP13
SCHEMBL13797776 0.77 NR4A2 (0.51) ALDH1A1ERN1GAAKDM4EMEN1

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-3574055-B1 METHOD FOR PRINTING TEXTILE FIBRE MATERIALS IN ACCORDANCE WITH THE INK-JET PRINTING PROCESS HUNTSMAN ADV MAT SWITZERLAND (CH) 2023-02-01 EP disclosed