SCHEMBL30576264

SCHEMBL30576264

CCc1sc(CC)c(P(c2ccccc2)c2ccccc2)c1P(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
TP53 P04637 1/20 0.36
ESR1 P03372 2/20 0.35
ESR2 Q92731 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
KDM4E B2RXH2 1/20 0.32
GAA P10253 1/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PSIP1 O75475 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL30576267 0.82 ACHE (0.32) TDP1ALDH1A1GAASMN1; SMN2
SCHEMBL30648501 0.81 TDP1 (0.38) CYP3A4TDP1LMNAHPGDHTT
SCHEMBL30576305 0.76 CYP3A4 (0.37) CYP3A4TDP1TP53ESR1ESR2
Propane SCHEMBL28233649 0.71 CYP3A4 (0.75) CYP3A4TDP1TP53ESR1ESR2
Propane SCHEMBL27796760 0.71 CYP3A4 (0.75) CYP3A4TDP1TP53ESR1ESR2
SCHEMBL30489078 0.71 CYP3A4 (0.50) CYP3A4TDP1ALDH1A1ESR1ESR2
Butane SCHEMBL27989459 0.69 CYP3A4 (0.71) CYP3A4TDP1TP53ESR1ESR2
Butane SCHEMBL28244852 0.69 CYP3A4 (0.71) CYP3A4TDP1TP53ESR1ESR2
SCHEMBL29024165 0.69 CYP3A4 (0.60) CYP3A4TDP1TP53ESR1ESR2
SCHEMBL22861496 0.68 CYP3A4 (0.41) CYP3A4TDP1TP53ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119306860-A Polypropylene catalyst for lithium battery separator, propylene polymer and preparation method thereof 中国石油天然气股份有限公司 2025-01-14 CN claimed
CN-116948067-A Catalyst for propylene polymerization and propylene polymerization or copolymerization reaction method 中国石油天然气股份有限公司 2023-10-27 CN claimed
CN-116948065-A Solid catalyst component for olefin polymerization, preparation method thereof and catalyst containing solid catalyst component 中国石油天然气股份有限公司 2023-10-27 CN claimed
CN-119306860-A Polypropylene catalyst for lithium battery separator, propylene polymer and preparation method thereof 中国石油天然气股份有限公司 2025-01-14 CN disclosed
CN-116948067-A Catalyst for propylene polymerization and propylene polymerization or copolymerization reaction method 中国石油天然气股份有限公司 2023-10-27 CN disclosed
CN-116948065-A Solid catalyst component for olefin polymerization, preparation method thereof and catalyst containing solid catalyst component 中国石油天然气股份有限公司 2023-10-27 CN disclosed