SCHEMBL30322706

SCHEMBL30322706

CCCCOCC1(COCCCC)c2ccccc2-c2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 4/20 0.44
CYP2C9 P11712 4/20 0.42
CYP2C19 P33261 4/20 0.42
NPSR1 Q6W5P4 2/20 0.42
CNR2 P34972 1/20 0.39
LTA4H P09960 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MEN1 O00255 1/20 0.38
RECQL P46063 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP1A2 P05177 2/20 0.37
ALDH1A1 P00352 3/20 0.36
TSHR P16473 2/20 0.36
APEX1 P27695 1/20 0.36
CYP19A1 P11511 1/20 0.36
HPGD P15428 1/20 0.36
TDP2 O95551 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL20995914 1.00 PDK2 (0.44) PDK2CYP2C9CYP2C19NPSR1CNR2
SCHEMBL30322467 0.89 PDK2 (0.40) PDK2CYP2C9CYP2C19NPSR1CNR2
SCHEMBL20995933 0.89 PDK2 (0.40) PDK2CYP2C9CYP2C19NPSR1CNR2
SCHEMBL5080025 0.89 PDK2 (0.41) PDK2CYP2C9CYP2C19NPSR1CNR2
SCHEMBL28154107 0.86 CYP2C9 (0.42) PDK2CYP2C9CYP2C19NPSR1CNR2
SCHEMBL15355422 0.86 PDK2 (0.38) PDK2CYP2C9CYP2C19NPSR1CNR2
SCHEMBL29757337 0.81 APEX1 (0.40) PDK2CYP2C9TDP1CYP1A2TSHR
SCHEMBL6437219 0.81 APEX1 (0.40) PDK2CYP2C9TDP1CYP1A2TSHR
SCHEMBL6512868 0.80 APEX1 (0.37) PDK2CYP2C9CYP1A2ALDH1A1TSHR
SCHEMBL5084634 0.80 CYP2C9 (0.34) PDK2CYP2C9CYP2C19NPSR1CNR2

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
CN-115926028-A Process for producing solid catalyst component for olefin polymerization, process for producing catalyst for olefin polymerization, and process for producing olefin polymer 住友化学株式会社 2023-04-07 CN disclosed
CN-110382574-B Heterophasic propylene polymer material and propylene resin composition 住友化学株式会社 2023-03-31 CN disclosed