SCHEMBL24637973

SCHEMBL24637973

COc1cc2c(F)c(C)c(O)cc2n(C)c1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.42
EGFR P00533 1/20 0.39
MAPT P10636 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
GAA P10253 2/20 0.37
POLB P06746 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
CYP19A1 P11511 2/20 0.36
NQO2 P16083 2/20 0.36
PDE3B Q13370 2/20 0.36
PDE3A Q14432 2/20 0.36
S100B P04271 1/20 0.36
ALDH1A1 P00352 3/20 0.34
TNF P01375 1/20 0.34
KDM4E B2RXH2 2/20 0.34
LMNA P02545 2/20 0.34
HPGD P15428 2/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL21614404 0.67 CYP3A4 (0.46) MAPTTP53TSHR
SCHEMBL26036440 0.67 PDE3B (0.44) TTRL3MBTL1KMT2AMEN1GAA
SCHEMBL31224092 0.67 S100B (0.46) TTRL3MBTL1KMT2AMEN1GAA
SCHEMBL24638021 0.65 POLB (0.34) KMT2AMEN1GAAPOLBALDH1A1
SCHEMBL11373100 0.64 MEN1 (0.50) TTRL3MBTL1KMT2AMEN1PDE3B
SCHEMBL2736480 0.63 CYP19A1 (0.46) MAPTL3MBTL1KMT2AMEN1POLB
SCHEMBL6677065 0.63 S100B (0.42) TTRL3MBTL1KMT2AMEN1GAA
SCHEMBL17576242 0.63 S100B (0.57) TTRMAPTL3MBTL1KMT2AMEN1
SCHEMBL15979066 0.63 KDM4E (0.44) MAPTL3MBTL1GAAPOLBTDP1
SCHEMBL19448893 0.63 KMT2A (0.49) TTRL3MBTL1KMT2AMEN1CYP19A1

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
WO-2022192598-A1 HETEROCYCLES AND USES THEREOF KUMQUAT BIOSCIENCES INC. (US) 2022-09-15 WO disclosed