SCHEMBL29757337

SCHEMBL29757337

CCOCC1(COCC)c2ccccc2-c2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.40
PDK2 Q15119 9/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CYP2D6 P10635 1/20 0.34
PGR P06401 2/20 0.33
KCNQ2 O43526 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
THRB P10828 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
APP P05067 1/20 0.32

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
SCHEMBL6437219 1.00 APEX1 (0.40) APEX1PDK2SMN1; SMN2CYP2D6PGR
SCHEMBL5082827 0.93 APEX1 (0.36) APEX1PDK2SMN1; SMN2CYP2D6PGR
SCHEMBL5082309 0.89 APEX1 (0.40) APEX1PDK2SMN1; SMN2CYP1A2THRB
SCHEMBL5078695 0.88 SMN1; SMN2 (0.34) APEX1PDK2SMN1; SMN2KCNQ2CYP1A2
SCHEMBL5084616 0.87 APEX1 (0.33) APEX1PDK2SMN1; SMN2KCNQ2CYP1A2
SCHEMBL5082314 0.85 SMN1; SMN2 (0.33) APEX1PDK2SMN1; SMN2CYP1A2
SCHEMBL28054297 0.85 PDK2 (0.44) APEX1PDK2SMN1; SMN2KCNQ2CYP1A2
SCHEMBL20995933 0.84 PDK2 (0.40) APEX1PDK2CYP2D6PGRCYP2C9
SCHEMBL30322467 0.84 PDK2 (0.40) APEX1PDK2CYP2D6PGRCYP2C9
SCHEMBL5084692 0.84 APEX1 (0.34) APEX1PDK2SMN1; SMN2CYP1A2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119161509-A Solid catalyst component for olefin polymerization 住友化学株式会社 2024-12-20 CN disclosed
CN-112011129-B Thermoplastic elastomer composition and method for producing same 住友化学株式会社 2023-06-30 CN disclosed
CN-114729068-A Catalyst composition for the polymerization of olefins 泰国聚乙烯有限公司 2022-07-08 CN disclosed